Benzene and substituted derivatives
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Benzyl Alcohol, puriss., Honeywell
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CAS: 100-51-6 Molecular Formula: C7H8O Molecular Weight (g/mol): 108.14 MDL Number: MFCD00004599,MFCD03792087 InChI Key: WVDDGKGOMKODPV-UHFFFAOYSA-N Synonym: benzyl alcohol,benzenemethanol,phenylcarbinol,benzoyl alcohol,hydroxytoluene,benzenecarbinol,phenylmethyl alcohol,alpha-toluenol,hydroxymethyl benzene,benzylalcohol PubChem CID: 244 ChEBI: CHEBI:17987 IUPAC Name: phenylmethanol SMILES: OCC1=CC=CC=C1
| PubChem CID | 244 |
|---|---|
| CAS | 100-51-6 |
| Molecular Weight (g/mol) | 108.14 |
| ChEBI | CHEBI:17987 |
| MDL Number | MFCD00004599,MFCD03792087 |
| SMILES | OCC1=CC=CC=C1 |
| Synonym | benzyl alcohol,benzenemethanol,phenylcarbinol,benzoyl alcohol,hydroxytoluene,benzenecarbinol,phenylmethyl alcohol,alpha-toluenol,hydroxymethyl benzene,benzylalcohol |
| IUPAC Name | phenylmethanol |
| InChI Key | WVDDGKGOMKODPV-UHFFFAOYSA-N |
| Molecular Formula | C7H8O |
Anisole, ReagentPlus™, 99%, Honeywell™
CAS: 100-66-3 Molecular Formula: C7H8O Molecular Weight (g/mol): 108.14 MDL Number: MFCD00008354 InChI Key: RDOXTESZEPMUJZ-UHFFFAOYSA-N Synonym: methoxybenzene,methyl phenyl ether,benzene, methoxy,anisol,phenyl methyl ether,phenoxymethane,anizol,phenol methyl ether,methoxy-benzene PubChem CID: 7519 ChEBI: CHEBI:16579 IUPAC Name: anisole SMILES: COC1=CC=CC=C1
| PubChem CID | 7519 |
|---|---|
| CAS | 100-66-3 |
| Molecular Weight (g/mol) | 108.14 |
| ChEBI | CHEBI:16579 |
| MDL Number | MFCD00008354 |
| SMILES | COC1=CC=CC=C1 |
| Synonym | methoxybenzene,methyl phenyl ether,benzene, methoxy,anisol,phenyl methyl ether,phenoxymethane,anizol,phenol methyl ether,methoxy-benzene |
| IUPAC Name | anisole |
| InChI Key | RDOXTESZEPMUJZ-UHFFFAOYSA-N |
| Molecular Formula | C7H8O |
Benzyl Alcohol, puriss., 99 to 100.5% (GC), Honeywell Riedel-de Haën™
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CAS: 100-51-6 Molecular Formula: C7H8O Molecular Weight (g/mol): 108.14 MDL Number: MFCD00004599,MFCD03792087 InChI Key: WVDDGKGOMKODPV-UHFFFAOYSA-N Synonym: benzyl alcohol,benzenemethanol,phenylcarbinol,benzoyl alcohol,hydroxytoluene,benzenecarbinol,phenylmethyl alcohol,alpha-toluenol,hydroxymethyl benzene,benzylalcohol PubChem CID: 244 ChEBI: CHEBI:17987 IUPAC Name: phenylmethanol SMILES: OCC1=CC=CC=C1
| PubChem CID | 244 |
|---|---|
| CAS | 100-51-6 |
| Molecular Weight (g/mol) | 108.14 |
| ChEBI | CHEBI:17987 |
| MDL Number | MFCD00004599,MFCD03792087 |
| SMILES | OCC1=CC=CC=C1 |
| Synonym | benzyl alcohol,benzenemethanol,phenylcarbinol,benzoyl alcohol,hydroxytoluene,benzenecarbinol,phenylmethyl alcohol,alpha-toluenol,hydroxymethyl benzene,benzylalcohol |
| IUPAC Name | phenylmethanol |
| InChI Key | WVDDGKGOMKODPV-UHFFFAOYSA-N |
| Molecular Formula | C7H8O |
Benzyl alcohol, Puriss. p.a., ACS reagent, ≥99.0% (GC), Honeywell Riedel-de Haën™
CAS: 100-51-6 Molecular Formula: C7H8O Molecular Weight (g/mol): 108.14 MDL Number: MFCD00004599,MFCD03792087 InChI Key: WVDDGKGOMKODPV-UHFFFAOYSA-N Synonym: benzyl alcohol,benzenemethanol,phenylcarbinol,benzoyl alcohol,hydroxytoluene,benzenecarbinol,phenylmethyl alcohol,alpha-toluenol,hydroxymethyl benzene,benzylalcohol PubChem CID: 244 ChEBI: CHEBI:17987 IUPAC Name: phenylmethanol SMILES: OCC1=CC=CC=C1
| PubChem CID | 244 |
|---|---|
| CAS | 100-51-6 |
| Molecular Weight (g/mol) | 108.14 |
| ChEBI | CHEBI:17987 |
| MDL Number | MFCD00004599,MFCD03792087 |
| SMILES | OCC1=CC=CC=C1 |
| Synonym | benzyl alcohol,benzenemethanol,phenylcarbinol,benzoyl alcohol,hydroxytoluene,benzenecarbinol,phenylmethyl alcohol,alpha-toluenol,hydroxymethyl benzene,benzylalcohol |
| IUPAC Name | phenylmethanol |
| InChI Key | WVDDGKGOMKODPV-UHFFFAOYSA-N |
| Molecular Formula | C7H8O |
Carbonylchlorobis(triphenylphosphine)iridium(I)
CAS: 14871-41-1 Molecular Formula: C37H30ClIrOP2 Molecular Weight (g/mol): 780.26 MDL Number: MFCD00009590 InChI Key: PEPSDKMVHYXIMJ-UHFFFAOYSA-M Synonym: carbonylchlorobis triphenylphosphine iridium i PubChem CID: 78076234 IUPAC Name: iridium;methanone;triphenylphosphane;chloride SMILES: Cl[Ir+].[C-]#[O+].C1=CC=C(C=C1)P(C1=CC=CC=C1)C1=CC=CC=C1.C1=CC=C(C=C1)P(C1=CC=CC=C1)C1=CC=CC=C1
| PubChem CID | 78076234 |
|---|---|
| CAS | 14871-41-1 |
| Molecular Weight (g/mol) | 780.26 |
| MDL Number | MFCD00009590 |
| SMILES | Cl[Ir+].[C-]#[O+].C1=CC=C(C=C1)P(C1=CC=CC=C1)C1=CC=CC=C1.C1=CC=C(C=C1)P(C1=CC=CC=C1)C1=CC=CC=C1 |
| Synonym | carbonylchlorobis triphenylphosphine iridium i |
| IUPAC Name | iridium;methanone;triphenylphosphane;chloride |
| InChI Key | PEPSDKMVHYXIMJ-UHFFFAOYSA-M |
| Molecular Formula | C37H30ClIrOP2 |
Irganox 1035, TRC
CAS: 41484-35-9 Molecular Formula: C38 H58 O6 S Molecular Weight (g/mol): 642.93 Synonym: Benzenepropanoic acid, 3,5-bis(1,1-dimethylethyl)-4-hydroxy-, 1,1'-(thiodi-2,1-ethanediyl) ester,Benzenepropanoic acid, 3,5-bis(1,1-dimethylethyl)-4-hydroxy-, thiodi-2,1-ethanediyl ester (9CI),2,2-Thiodiethylene bis-[(3-(3,5-di-tert-butyl-4-hydroxyphenyl)propionate],2,2'-Thiodiethyl bis[3-(3,5-di-tert-butyl-4-hydroxyphenyl)propionate],2,2'-Thiodiethylene bis[3-(3,5-di-tert-butyl-4-hydroxyhydrocinnamate],2,2'-Thiodiethylene bis[3-(3,5-di-tert-butyl-4-hydroxyphenyl)propionate],2-(3,5-Di-tert-butyl-4-hydroxyphenyl)propionic acid 2,2'-thiobisethanol diester,3,5-Di-tert-butyl-4-hydroxybenzenepropanoic acid thiodi-2,1-ethanediyl ester,3-Thia-1,5-pentanediol bis[3-(3,5-di-tert-butyl-4-hydroxyphenyl)propionate],AO 75,Anox 70,Antioxidant 1035,Bis[(3,5-di-tert-butyl-4-hydroxyphenyl)propionyl-2-oxyethyl] sulfide,Bis[2-[3-(3,5-di-tert-butyl-4-hydroxyphenyl)propionyloxy]ethyl] sulfide,Chinox 1035,Chinox S 35,Durad AX 15,Fenozan 30,IR 1035,Irganox 1035,Irganox 1035FF,Irganox L 1035,Irganox L 115,L 115,Naugard EL 50,S 35,Thiodi(2,1-ethanediyl) bis[3-(3,5-di-tert-butyl-4-hydroxyphenyl)propionate],Thiodiethylene bis(3,5-di-tert-butyl-4-hydroxyhydrocinnamate),Thiodiethylene bis[3-(3,5-di-tert-butyl-4-hydroxyphenyl)propionate,Thiodiethylene glycol bis[3-(3,5-di-tert-butyl-4-hydroxyphenyl)propionate],Thiodiethylene glycol bis[β-(3,5-di-tert-butyl-4-hydroxyphenyl)propionate],Thiodiethylene glycol bis[β-(4-hydroxy-3,5-di(tert-butyl)phenyl)propionate] IUPAC Name: 2-[2-[3-(3,5-ditert-butyl-4-hydroxyphenyl)propanoyloxy]ethylsulfanyl]ethyl 3-(3,5-ditert-butyl-4-hydroxyphenyl)propanoate SMILES: CC(C)(C)c1cc(CCC(=O)OCCSCCOC(=O)CCc2cc(c(O)c(c2)C(C)(C)C)C(C)(C)C)cc(c1O)C(C)(C)C
| CAS | 41484-35-9 |
|---|---|
| Molecular Weight (g/mol) | 642.93 |
| SMILES | CC(C)(C)c1cc(CCC(=O)OCCSCCOC(=O)CCc2cc(c(O)c(c2)C(C)(C)C)C(C)(C)C)cc(c1O)C(C)(C)C |
| Synonym | Benzenepropanoic acid, 3,5-bis(1,1-dimethylethyl)-4-hydroxy-, 1,1'-(thiodi-2,1-ethanediyl) ester,Benzenepropanoic acid, 3,5-bis(1,1-dimethylethyl)-4-hydroxy-, thiodi-2,1-ethanediyl ester (9CI),2,2-Thiodiethylene bis-[(3-(3,5-di-tert-butyl-4-hydroxyphenyl)propionate],2,2'-Thiodiethyl bis[3-(3,5-di-tert-butyl-4-hydroxyphenyl)propionate],2,2'-Thiodiethylene bis[3-(3,5-di-tert-butyl-4-hydroxyhydrocinnamate],2,2'-Thiodiethylene bis[3-(3,5-di-tert-butyl-4-hydroxyphenyl)propionate],2-(3,5-Di-tert-butyl-4-hydroxyphenyl)propionic acid 2,2'-thiobisethanol diester,3,5-Di-tert-butyl-4-hydroxybenzenepropanoic acid thiodi-2,1-ethanediyl ester,3-Thia-1,5-pentanediol bis[3-(3,5-di-tert-butyl-4-hydroxyphenyl)propionate],AO 75,Anox 70,Antioxidant 1035,Bis[(3,5-di-tert-butyl-4-hydroxyphenyl)propionyl-2-oxyethyl] sulfide,Bis[2-[3-(3,5-di-tert-butyl-4-hydroxyphenyl)propionyloxy]ethyl] sulfide,Chinox 1035,Chinox S 35,Durad AX 15,Fenozan 30,IR 1035,Irganox 1035,Irganox 1035FF,Irganox L 1035,Irganox L 115,L 115,Naugard EL 50,S 35,Thiodi(2,1-ethanediyl) bis[3-(3,5-di-tert-butyl-4-hydroxyphenyl)propionate],Thiodiethylene bis(3,5-di-tert-butyl-4-hydroxyhydrocinnamate),Thiodiethylene bis[3-(3,5-di-tert-butyl-4-hydroxyphenyl)propionate,Thiodiethylene glycol bis[3-(3,5-di-tert-butyl-4-hydroxyphenyl)propionate],Thiodiethylene glycol bis[β-(3,5-di-tert-butyl-4-hydroxyphenyl)propionate],Thiodiethylene glycol bis[β-(4-hydroxy-3,5-di(tert-butyl)phenyl)propionate] |
| IUPAC Name | 2-[2-[3-(3,5-ditert-butyl-4-hydroxyphenyl)propanoyloxy]ethylsulfanyl]ethyl 3-(3,5-ditert-butyl-4-hydroxyphenyl)propanoate |
| Molecular Formula | C38 H58 O6 S |
Carbonylhydridotris(triphenylphosphine)iridium(I), Ir 18.6% min, Thermo Scientific™
CAS: 17250-25-8 Molecular Formula: C55H46IrOP3 Molecular Weight (g/mol): 1008.11 MDL Number: MFCD00015525 InChI Key: IOPVMNYABUEALT-UHFFFAOYSA-N Synonym: carbonylhydridotris triphenylphosphine iridium i,iridium 1+ formaldehyde tris triphenylphosphine hydride PubChem CID: 92135237 IUPAC Name: formaldehyde;hydride;iridium;triphenylphosphane SMILES: [IrH].[C-]#[O+].C1=CC=C(C=C1)P(C1=CC=CC=C1)C1=CC=CC=C1.C1=CC=C(C=C1)P(C1=CC=CC=C1)C1=CC=CC=C1.C1=CC=C(C=C1)P(C1=CC=CC=C1)C1=CC=CC=C1
| PubChem CID | 92135237 |
|---|---|
| CAS | 17250-25-8 |
| Molecular Weight (g/mol) | 1008.11 |
| MDL Number | MFCD00015525 |
| SMILES | [IrH].[C-]#[O+].C1=CC=C(C=C1)P(C1=CC=CC=C1)C1=CC=CC=C1.C1=CC=C(C=C1)P(C1=CC=CC=C1)C1=CC=CC=C1.C1=CC=C(C=C1)P(C1=CC=CC=C1)C1=CC=CC=C1 |
| Synonym | carbonylhydridotris triphenylphosphine iridium i,iridium 1+ formaldehyde tris triphenylphosphine hydride |
| IUPAC Name | formaldehyde;hydride;iridium;triphenylphosphane |
| InChI Key | IOPVMNYABUEALT-UHFFFAOYSA-N |
| Molecular Formula | C55H46IrOP3 |
(±)-α-Methoxyphenylacetic acid, Honeywell Fluka™
CAS: 7021-09-2 Molecular Formula: C9H10O3 Molecular Weight (g/mol): 166.18 MDL Number: MFCD00064217 InChI Key: DIWVBIXQCNRCFE-UHFFFAOYNA-N PubChem CID: 107202 IUPAC Name: 2-methoxy-2-phenylacetic acid
| PubChem CID | 107202 |
|---|---|
| CAS | 7021-09-2 |
| Molecular Weight (g/mol) | 166.18 |
| MDL Number | MFCD00064217 |
| IUPAC Name | 2-methoxy-2-phenylacetic acid |
| InChI Key | DIWVBIXQCNRCFE-UHFFFAOYNA-N |
| Molecular Formula | C9H10O3 |
α,α,α-Trifluorotoluene, ≥99%, Honeywell™
CAS: 98-08-8 Molecular Formula: C7H5F3 Molecular Weight (g/mol): 146.112 MDL Number: MFCD00000372 InChI Key: GETTZEONDQJALK-UHFFFAOYSA-N Synonym: benzotrifluoride,trifluoromethyl benzene,alpha,alpha,alpha-trifluorotoluene,phenylfluoroform,benzene, trifluoromethyl,benzenyl fluoride,benzylidyne fluoride,usaf ma-16,a,a,a-trifluorotoluene,trifluoro toluene PubChem CID: 7368 ChEBI: CHEBI:36810 IUPAC Name: trifluoromethylbenzene SMILES: C1=CC=C(C=C1)C(F)(F)F
| PubChem CID | 7368 |
|---|---|
| CAS | 98-08-8 |
| Molecular Weight (g/mol) | 146.112 |
| ChEBI | CHEBI:36810 |
| MDL Number | MFCD00000372 |
| SMILES | C1=CC=C(C=C1)C(F)(F)F |
| Synonym | benzotrifluoride,trifluoromethyl benzene,alpha,alpha,alpha-trifluorotoluene,phenylfluoroform,benzene, trifluoromethyl,benzenyl fluoride,benzylidyne fluoride,usaf ma-16,a,a,a-trifluorotoluene,trifluoro toluene |
| IUPAC Name | trifluoromethylbenzene |
| InChI Key | GETTZEONDQJALK-UHFFFAOYSA-N |
| Molecular Formula | C7H5F3 |
Benzyl Alcohol, ReagentPlus™, ≥99%, Honeywell™
CAS: 100-51-6 Molecular Formula: C7H8O Molecular Weight (g/mol): 108.14 MDL Number: MFCD00004599,MFCD03792087 InChI Key: WVDDGKGOMKODPV-UHFFFAOYSA-N Synonym: benzyl alcohol,benzenemethanol,phenylcarbinol,benzoyl alcohol,hydroxytoluene,benzenecarbinol,phenylmethyl alcohol,alpha-toluenol,hydroxymethyl benzene,benzylalcohol PubChem CID: 244 ChEBI: CHEBI:17987 IUPAC Name: phenylmethanol SMILES: OCC1=CC=CC=C1
| PubChem CID | 244 |
|---|---|
| CAS | 100-51-6 |
| Molecular Weight (g/mol) | 108.14 |
| ChEBI | CHEBI:17987 |
| MDL Number | MFCD00004599,MFCD03792087 |
| SMILES | OCC1=CC=CC=C1 |
| Synonym | benzyl alcohol,benzenemethanol,phenylcarbinol,benzoyl alcohol,hydroxytoluene,benzenecarbinol,phenylmethyl alcohol,alpha-toluenol,hydroxymethyl benzene,benzylalcohol |
| IUPAC Name | phenylmethanol |
| InChI Key | WVDDGKGOMKODPV-UHFFFAOYSA-N |
| Molecular Formula | C7H8O |
4-(Dimethylamino)benzaldehyde, ≥99% (HPLC), Honeywell Fluka™
CAS: 100-10-7 Molecular Formula: C9H11NO Molecular Weight (g/mol): 149.19 MDL Number: MFCD00003381 InChI Key: BGNGWHSBYQYVRX-UHFFFAOYSA-N Synonym: 4-dimethylamino benzaldehyde,p-dimethylaminobenzaldehyde,ehrlich's reagent,p-formyldimethylaniline,benzaldehyde, 4-dimethylamino,p-dimethylamino benzaldehyde,p-formyl-n,n-dimethylaniline,n,n-dimethyl-p-aminobenzaldehyde,p-n,n-dimethylamino benzaldehyde,4-dimethylaminobenzenecarbonal PubChem CID: 7479 IUPAC Name: 4-(dimethylamino)benzaldehyde SMILES: CN(C)C1=CC=C(C=O)C=C1
| PubChem CID | 7479 |
|---|---|
| CAS | 100-10-7 |
| Molecular Weight (g/mol) | 149.19 |
| MDL Number | MFCD00003381 |
| SMILES | CN(C)C1=CC=C(C=O)C=C1 |
| Synonym | 4-dimethylamino benzaldehyde,p-dimethylaminobenzaldehyde,ehrlich's reagent,p-formyldimethylaniline,benzaldehyde, 4-dimethylamino,p-dimethylamino benzaldehyde,p-formyl-n,n-dimethylaniline,n,n-dimethyl-p-aminobenzaldehyde,p-n,n-dimethylamino benzaldehyde,4-dimethylaminobenzenecarbonal |
| IUPAC Name | 4-(dimethylamino)benzaldehyde |
| InChI Key | BGNGWHSBYQYVRX-UHFFFAOYSA-N |
| Molecular Formula | C9H11NO |
Benzyl alcohol, ACS Reagent, ≥99%, Honeywell Riedel-de Haën™
CAS: 100-51-6 Molecular Formula: C7H8O Molecular Weight (g/mol): 108.14 MDL Number: MFCD00004599,MFCD03792087 InChI Key: WVDDGKGOMKODPV-UHFFFAOYSA-N Synonym: benzyl alcohol,benzenemethanol,phenylcarbinol,benzoyl alcohol,hydroxytoluene,benzenecarbinol,phenylmethyl alcohol,alpha-toluenol,hydroxymethyl benzene,benzylalcohol PubChem CID: 244 ChEBI: CHEBI:17987 IUPAC Name: phenylmethanol SMILES: OCC1=CC=CC=C1
| PubChem CID | 244 |
|---|---|
| CAS | 100-51-6 |
| Molecular Weight (g/mol) | 108.14 |
| ChEBI | CHEBI:17987 |
| MDL Number | MFCD00004599,MFCD03792087 |
| SMILES | OCC1=CC=CC=C1 |
| Synonym | benzyl alcohol,benzenemethanol,phenylcarbinol,benzoyl alcohol,hydroxytoluene,benzenecarbinol,phenylmethyl alcohol,alpha-toluenol,hydroxymethyl benzene,benzylalcohol |
| IUPAC Name | phenylmethanol |
| InChI Key | WVDDGKGOMKODPV-UHFFFAOYSA-N |
| Molecular Formula | C7H8O |
3-(3-Chlorophenylsulfonamido)benzoic acid, 96%, Thermo Scientific™
CAS: 749884-42-2 Molecular Formula: C13H10ClNO4S Molecular Weight (g/mol): 311.736 MDL Number: MFCD06409487 InChI Key: APBOVLPLJFJSRI-UHFFFAOYSA-N Synonym: 3-3-chlorophenylsulfonamido benzoic acid,3-3-chloro-benzenesulfonylamino-benzoic acid,3-3-chlorophenyl sulfonyl amino benzoic acid,benzoicacid, 3-3-chlorophenyl sulfonyl amino,3-3-chlorobenzenesulfonamido benzoic acid,amberlite ir-120,3-3-chlorophenyl sulfonylamino benzoic acid,3-3-chlorophenyl sulfonamido benzoic acid PubChem CID: 8190984 IUPAC Name: 3-[(3-chlorophenyl)sulfonylamino]benzoic acid SMILES: C1=CC(=CC(=C1)NS(=O)(=O)C2=CC(=CC=C2)Cl)C(=O)O
| PubChem CID | 8190984 |
|---|---|
| CAS | 749884-42-2 |
| Molecular Weight (g/mol) | 311.736 |
| MDL Number | MFCD06409487 |
| SMILES | C1=CC(=CC(=C1)NS(=O)(=O)C2=CC(=CC=C2)Cl)C(=O)O |
| Synonym | 3-3-chlorophenylsulfonamido benzoic acid,3-3-chloro-benzenesulfonylamino-benzoic acid,3-3-chlorophenyl sulfonyl amino benzoic acid,benzoicacid, 3-3-chlorophenyl sulfonyl amino,3-3-chlorobenzenesulfonamido benzoic acid,amberlite ir-120,3-3-chlorophenyl sulfonylamino benzoic acid,3-3-chlorophenyl sulfonamido benzoic acid |
| IUPAC Name | 3-[(3-chlorophenyl)sulfonylamino]benzoic acid |
| InChI Key | APBOVLPLJFJSRI-UHFFFAOYSA-N |
| Molecular Formula | C13H10ClNO4S |