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Benzenoids

Organic compounds that are derived from or have a benzene group in their molecular structure. Benzene is an aromatic organic molecule composed of 6 carbon atoms and 6 hydrogen atoms that form a ring. Includes derivatives and substituted molecules.
Benzene and substituted derivatives (27)
Indanes (12)
Tetralins (4)
Phenols (4)
Naphthalenes (2)

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1 – 15 of 22 results
1

Diphenylmethane, 99%

CAS: 101-81-5 Molecular Formula: C13H12 Molecular Weight (g/mol): 168.24 MDL Number: MFCD00004781 InChI Key: CZZYITDELCSZES-UHFFFAOYSA-N Synonym: diphenylmethane,ditan,ditane,benzene, 1,1'-methylenebis,diphenyl methane,benzene, benzyl,methane, diphenyl,1,1'-dimethylenebis benzene,benzene, phenylmethyl,methylenedibenzene PubChem CID: 7580 ChEBI: CHEBI:38884 IUPAC Name: benzylbenzene SMILES: C(C1=CC=CC=C1)C1=CC=CC=C1

PubChem CID 7580
CAS 101-81-5
Molecular Weight (g/mol) 168.24
ChEBI CHEBI:38884
MDL Number MFCD00004781
SMILES C(C1=CC=CC=C1)C1=CC=CC=C1
Synonym diphenylmethane,ditan,ditane,benzene, 1,1'-methylenebis,diphenyl methane,benzene, benzyl,methane, diphenyl,1,1'-dimethylenebis benzene,benzene, phenylmethyl,methylenedibenzene
IUPAC Name benzylbenzene
InChI Key CZZYITDELCSZES-UHFFFAOYSA-N
Molecular Formula C13H12
2

1-Aminoindane, 99%

CAS: 34698-41-4 Molecular Formula: C9H12N Molecular Weight (g/mol): 134.20 MDL Number: MFCD00003799 InChI Key: XJEVHMGJSYVQBQ-VIFPVBQESA-O Synonym: 1-aminoindan,1-aminoindane,1-indanamine,indan-1-ylamine,indanamin,aminoindan,indanylamine,indan-1-amine,1h-inden-1-amine, 2,3-dihydro,2,3-dihydro-1h-inden-1-ylamine PubChem CID: 123445 IUPAC Name: 2,3-dihydro-1H-inden-1-amine SMILES: [NH3+][C@H]1CCC2=CC=CC=C12

PubChem CID 123445
CAS 34698-41-4
Molecular Weight (g/mol) 134.20
MDL Number MFCD00003799
SMILES [NH3+][C@H]1CCC2=CC=CC=C12
Synonym 1-aminoindan,1-aminoindane,1-indanamine,indan-1-ylamine,indanamin,aminoindan,indanylamine,indan-1-amine,1h-inden-1-amine, 2,3-dihydro,2,3-dihydro-1h-inden-1-ylamine
IUPAC Name 2,3-dihydro-1H-inden-1-amine
InChI Key XJEVHMGJSYVQBQ-VIFPVBQESA-O
Molecular Formula C9H12N
3

3,5-Dimethoxy-4-methylbenzoic acid, 97%

CAS: 61040-81-1 Molecular Formula: C10H12O4 Molecular Weight (g/mol): 196.202 MDL Number: MFCD00017506 InChI Key: QIBMVRYNEXOCCF-UHFFFAOYSA-N Synonym: 3,5-dimethoxy-4-methyl-benzoic acid,benzoic acid,3,5-dimethoxy-4-methyl,3,5-dimethoxy-4-methylbenzoicacid,acmc-1b58y,3,5-dimethoxy4-methylbenzoic acid,4-methyl-3,5-dimethoxybenzoic acid,3,5-dimethoxy-p-toluic acid,labotest-bb lt00455447,3,5-dimethoxy-4-methyl benzoic acid,3,5-di-methoxy-4-methyl-benzoic acid PubChem CID: 3764486 IUPAC Name: 3,5-dimethoxy-4-methylbenzoic acid SMILES: CC1=C(C=C(C=C1OC)C(=O)O)OC

PubChem CID 3764486
CAS 61040-81-1
Molecular Weight (g/mol) 196.202
MDL Number MFCD00017506
SMILES CC1=C(C=C(C=C1OC)C(=O)O)OC
Synonym 3,5-dimethoxy-4-methyl-benzoic acid,benzoic acid,3,5-dimethoxy-4-methyl,3,5-dimethoxy-4-methylbenzoicacid,acmc-1b58y,3,5-dimethoxy4-methylbenzoic acid,4-methyl-3,5-dimethoxybenzoic acid,3,5-dimethoxy-p-toluic acid,labotest-bb lt00455447,3,5-dimethoxy-4-methyl benzoic acid,3,5-di-methoxy-4-methyl-benzoic acid
IUPAC Name 3,5-dimethoxy-4-methylbenzoic acid
InChI Key QIBMVRYNEXOCCF-UHFFFAOYSA-N
Molecular Formula C10H12O4
4

(+/-)-1,2,3,4-Tetrahydro-1-naphthylamine, 97%

CAS: 2217-40-5 Molecular Formula: C10H14ClN Molecular Weight (g/mol): 183.68 MDL Number: MFCD00001740 InChI Key: DETWFIUAXSWCIK-UHFFFAOYNA-N Synonym: 1,2,3,4-tetrahydro-1-naphthylamine,1-aminotetralin,aminotetralin,1-amino-1,2,3,4-tetrahydro-naphthalene,aminotetralin czech,tetrahydro-beta-naphthylamine,1-amino-1,2,3,4-tetrahydronaphthalene,1-naphthalenamine, 1,2,3,4-tetrahydro,1,2,3,4-tetrahydronaphthylamine,beta-1,2,3,4-tetrahydronaphthylamine PubChem CID: 18066 IUPAC Name: 1,2,3,4-tetrahydronaphthalen-1-amine SMILES: [Cl-].[NH3+]C1CCCC2=CC=CC=C12

PubChem CID 18066
CAS 2217-40-5
Molecular Weight (g/mol) 183.68
MDL Number MFCD00001740
SMILES [Cl-].[NH3+]C1CCCC2=CC=CC=C12
Synonym 1,2,3,4-tetrahydro-1-naphthylamine,1-aminotetralin,aminotetralin,1-amino-1,2,3,4-tetrahydro-naphthalene,aminotetralin czech,tetrahydro-beta-naphthylamine,1-amino-1,2,3,4-tetrahydronaphthalene,1-naphthalenamine, 1,2,3,4-tetrahydro,1,2,3,4-tetrahydronaphthylamine,beta-1,2,3,4-tetrahydronaphthylamine
IUPAC Name 1,2,3,4-tetrahydronaphthalen-1-amine
InChI Key DETWFIUAXSWCIK-UHFFFAOYNA-N
Molecular Formula C10H14ClN
5

Gossypol, 98+%

CAS: 303-45-7 Molecular Formula: C30H30O8 Molecular Weight (g/mol): 518.56 MDL Number: MFCD00017352 InChI Key: QBKSWRVVCFFDOT-UHFFFAOYSA-N Synonym: gossypol,--gossypol,+-gossypol,pogosin,tash 1,racemic-gossypol,r---gossypol,r-gossypol,+--gossypol,+/--gossypol PubChem CID: 3503 ChEBI: CHEBI:28584 SMILES: CC(C)C1=C(O)C(O)=C(C=O)C2=C(O)C(=C(C)C=C12)C1=C(O)C2=C(C=O)C(O)=C(O)C(C(C)C)=C2C=C1C

PubChem CID 3503
CAS 303-45-7
Molecular Weight (g/mol) 518.56
ChEBI CHEBI:28584
MDL Number MFCD00017352
SMILES CC(C)C1=C(O)C(O)=C(C=O)C2=C(O)C(=C(C)C=C12)C1=C(O)C2=C(C=O)C(O)=C(O)C(C(C)C)=C2C=C1C
Synonym gossypol,--gossypol,+-gossypol,pogosin,tash 1,racemic-gossypol,r---gossypol,r-gossypol,+--gossypol,+/--gossypol
InChI Key QBKSWRVVCFFDOT-UHFFFAOYSA-N
Molecular Formula C30H30O8
7

1,2,3,4-Tetrahydro-1-naphthylamine, 97%

CAS: 2217-40-5 Molecular Formula: C10H14ClN Molecular Weight (g/mol): 183.68 MDL Number: MFCD00001740 InChI Key: DETWFIUAXSWCIK-UHFFFAOYNA-N Synonym: 1,2,3,4-tetrahydro-1-naphthylamine,1-aminotetralin,aminotetralin,1-amino-1,2,3,4-tetrahydro-naphthalene,aminotetralin czech,tetrahydro-beta-naphthylamine,1-amino-1,2,3,4-tetrahydronaphthalene,1-naphthalenamine, 1,2,3,4-tetrahydro,1,2,3,4-tetrahydronaphthylamine,beta-1,2,3,4-tetrahydronaphthylamine PubChem CID: 18066 IUPAC Name: 1,2,3,4-tetrahydronaphthalen-1-amine SMILES: [Cl-].[NH3+]C1CCCC2=CC=CC=C12

PubChem CID 18066
CAS 2217-40-5
Molecular Weight (g/mol) 183.68
MDL Number MFCD00001740
SMILES [Cl-].[NH3+]C1CCCC2=CC=CC=C12
Synonym 1,2,3,4-tetrahydro-1-naphthylamine,1-aminotetralin,aminotetralin,1-amino-1,2,3,4-tetrahydro-naphthalene,aminotetralin czech,tetrahydro-beta-naphthylamine,1-amino-1,2,3,4-tetrahydronaphthalene,1-naphthalenamine, 1,2,3,4-tetrahydro,1,2,3,4-tetrahydronaphthylamine,beta-1,2,3,4-tetrahydronaphthylamine
IUPAC Name 1,2,3,4-tetrahydronaphthalen-1-amine
InChI Key DETWFIUAXSWCIK-UHFFFAOYNA-N
Molecular Formula C10H14ClN
8
Promotions Available

Quinhydrone, 98%

CAS: 106-34-3 Molecular Formula: C12H10O4 Molecular Weight (g/mol): 218.21 MDL Number: MFCD00010310 InChI Key: BDJXVNRFAQSMAA-UHFFFAOYSA-N Synonym: quinhydrone,green hydroquinone,p-benzoquinhydrone,chinhydron,chinhydron czech,unii-p4a66lq3qj,hydroquinone, compd. with p-benzoquinone,p-benzoquinone, compd. with hydroquinone,2,5-cyclohexadiene-1,4-dione, compd. with 1,4-benzenediol 1:1,p-benzoquinone-hydroquinone compound 1:1 PubChem CID: 7801 ChEBI: CHEBI:26491 IUPAC Name: benzene-1,4-diol;cyclohexa-2,5-diene-1,4-dione SMILES: OC1=CC=C(O)C=C1.O=C1C=CC(=O)C=C1

PubChem CID 7801
CAS 106-34-3
Molecular Weight (g/mol) 218.21
ChEBI CHEBI:26491
MDL Number MFCD00010310
SMILES OC1=CC=C(O)C=C1.O=C1C=CC(=O)C=C1
Synonym quinhydrone,green hydroquinone,p-benzoquinhydrone,chinhydron,chinhydron czech,unii-p4a66lq3qj,hydroquinone, compd. with p-benzoquinone,p-benzoquinone, compd. with hydroquinone,2,5-cyclohexadiene-1,4-dione, compd. with 1,4-benzenediol 1:1,p-benzoquinone-hydroquinone compound 1:1
IUPAC Name benzene-1,4-diol;cyclohexa-2,5-diene-1,4-dione
InChI Key BDJXVNRFAQSMAA-UHFFFAOYSA-N
Molecular Formula C12H10O4
9

5-Bromo-2-fluorobenzylamine hydrochloride, 97%

CAS: 202865-69-8 Molecular Formula: C7H8BrFN Molecular Weight (g/mol): 205.05 MDL Number: MFCD00143426 InChI Key: PDKBJZGGXHTHNC-UHFFFAOYSA-O Synonym: 5-bromo-2-fluorobenzylamine hydrochloride,5-bromo-2-fluorophenyl methanamine hydrochloride,5-bromo-2-fluorobenzylamine hcl,5-bromo-2-fluorophenyl methanamine hcl,1-5-bromo-2-fluorophenyl methanamine hydrochloride,pubchem3227,acmc-1cpb5,rarechem al bd 0325,akos bbv-005136,5-bromo-2-fluorobenzyl amine hcl PubChem CID: 2724903 SMILES: [NH3+]CC1=CC(Br)=CC=C1F

PubChem CID 2724903
CAS 202865-69-8
Molecular Weight (g/mol) 205.05
MDL Number MFCD00143426
SMILES [NH3+]CC1=CC(Br)=CC=C1F
Synonym 5-bromo-2-fluorobenzylamine hydrochloride,5-bromo-2-fluorophenyl methanamine hydrochloride,5-bromo-2-fluorobenzylamine hcl,5-bromo-2-fluorophenyl methanamine hcl,1-5-bromo-2-fluorophenyl methanamine hydrochloride,pubchem3227,acmc-1cpb5,rarechem al bd 0325,akos bbv-005136,5-bromo-2-fluorobenzyl amine hcl
InChI Key PDKBJZGGXHTHNC-UHFFFAOYSA-O
Molecular Formula C7H8BrFN
10

(1S,2R)-(-)-cis-1-Amino-2-indanol, 99%

CAS: 126456-43-7 Molecular Formula: C9H12NO Molecular Weight (g/mol): 150.20 MDL Number: MFCD00216655 InChI Key: LOPKSXMQWBYUOI-BDAKNGLRSA-O PubChem CID: 9866743 SMILES: [NH3+][C@@H]1[C@H](O)CC2=CC=CC=C12

PubChem CID 9866743
CAS 126456-43-7
Molecular Weight (g/mol) 150.20
MDL Number MFCD00216655
SMILES [NH3+][C@@H]1[C@H](O)CC2=CC=CC=C12
InChI Key LOPKSXMQWBYUOI-BDAKNGLRSA-O
Molecular Formula C9H12NO
11

(1R,2S)-(+)-cis-1-Amino-2-indanol, 98%

CAS: 136030-00-7 Molecular Formula: C9H12NO Molecular Weight (g/mol): 150.20 MDL Number: MFCD00216656,MFCD01318239 InChI Key: LOPKSXMQWBYUOI-DTWKUNHWSA-O Synonym: 1r,2s-1-amino-2-indanol,1r,2s-1-amino-2,3-dihydro-1h-inden-2-ol,cis-1-amino-2-indanol,1r,2s-+-cis-1-amino-2-indanol,cis-1-amino-2,3-dihydro-1h-inden-2-ol,1r,2s-+-1-amino-2-hydroxyindan,1r,2s-1-amino-2-hydroxyindane,1r,2s-+-1-amino-2-indanol,1r,2s-+-cis-1-aminoindan-2-ol,1r,2s-cis-1-amino-2-indanol PubChem CID: 2725045 IUPAC Name: (1R,2S)-2-hydroxy-2,3-dihydro-1H-inden-1-aminium SMILES: [NH3+][C@H]1[C@@H](O)CC2=CC=CC=C12

PubChem CID 2725045
CAS 136030-00-7
Molecular Weight (g/mol) 150.20
MDL Number MFCD00216656,MFCD01318239
SMILES [NH3+][C@H]1[C@@H](O)CC2=CC=CC=C12
Synonym 1r,2s-1-amino-2-indanol,1r,2s-1-amino-2,3-dihydro-1h-inden-2-ol,cis-1-amino-2-indanol,1r,2s-+-cis-1-amino-2-indanol,cis-1-amino-2,3-dihydro-1h-inden-2-ol,1r,2s-+-1-amino-2-hydroxyindan,1r,2s-1-amino-2-hydroxyindane,1r,2s-+-1-amino-2-indanol,1r,2s-+-cis-1-aminoindan-2-ol,1r,2s-cis-1-amino-2-indanol
IUPAC Name (1R,2S)-2-hydroxy-2,3-dihydro-1H-inden-1-aminium
InChI Key LOPKSXMQWBYUOI-DTWKUNHWSA-O
Molecular Formula C9H12NO
12

Benzyltrimethylammonium hydroxide, 40% w/w in methanol

CAS: 100-85-6 Molecular Formula: C10H17NO Molecular Weight (g/mol): 167.252 MDL Number: MFCD00008281 InChI Key: NDKBVBUGCNGSJJ-UHFFFAOYSA-M Synonym: benzyltrimethylammonium hydroxide,triton b,n,n,n-trimethyl-1-phenylmethanaminium hydroxide,trimethylbenzylammonium hydroxide,benzyl trimethylammonium hydroxide,benzyl trimethyl ammonium hydroxide,trimethyl benzylammonium hydroxide,sumquat 2311,benzyltrimetylammonium hydroxide,n,n,n-trimethylbenzenemethanaminium hydroxide PubChem CID: 66854 IUPAC Name: benzyl(trimethyl)azanium;hydroxide SMILES: C[N+](C)(C)CC1=CC=CC=C1.[OH-]

PubChem CID 66854
CAS 100-85-6
Molecular Weight (g/mol) 167.252
MDL Number MFCD00008281
SMILES C[N+](C)(C)CC1=CC=CC=C1.[OH-]
Synonym benzyltrimethylammonium hydroxide,triton b,n,n,n-trimethyl-1-phenylmethanaminium hydroxide,trimethylbenzylammonium hydroxide,benzyl trimethylammonium hydroxide,benzyl trimethyl ammonium hydroxide,trimethyl benzylammonium hydroxide,sumquat 2311,benzyltrimetylammonium hydroxide,n,n,n-trimethylbenzenemethanaminium hydroxide
IUPAC Name benzyl(trimethyl)azanium;hydroxide
InChI Key NDKBVBUGCNGSJJ-UHFFFAOYSA-M
Molecular Formula C10H17NO
13

(1S,2R)-(-)-cis-1-Amino-2-indanol, 97%

CAS: 126456-43-7 Molecular Formula: C9H12NO Molecular Weight (g/mol): 150.20 MDL Number: MFCD00216655 InChI Key: LOPKSXMQWBYUOI-BDAKNGLRSA-O Synonym: 1s,2r-1-amino-2,3-dihydro-1h-inden-2-ol,1s,2r---cis-1-amino-2-indanol,1s,2r---1-amino-2-indanol,1s,2r-1-amino-2-indanol,1s,2r-cis-1-amino-2-indanol,cis-1s,2r-1-amino-2-indanol,1s,2r-1-amino-indan-2-ol,1s,2r---cis-1-aminoindan-2-ol,1s,2r---1-amino-2-hydroxyindan,1s, 2r-cis-1-amino-2-indanol PubChem CID: 9866743 IUPAC Name: (1S,2R)-1-amino-2,3-dihydro-1H-inden-2-ol SMILES: [NH3+][C@@H]1[C@H](O)CC2=CC=CC=C12

PubChem CID 9866743
CAS 126456-43-7
Molecular Weight (g/mol) 150.20
MDL Number MFCD00216655
SMILES [NH3+][C@@H]1[C@H](O)CC2=CC=CC=C12
Synonym 1s,2r-1-amino-2,3-dihydro-1h-inden-2-ol,1s,2r---cis-1-amino-2-indanol,1s,2r---1-amino-2-indanol,1s,2r-1-amino-2-indanol,1s,2r-cis-1-amino-2-indanol,cis-1s,2r-1-amino-2-indanol,1s,2r-1-amino-indan-2-ol,1s,2r---cis-1-aminoindan-2-ol,1s,2r---1-amino-2-hydroxyindan,1s, 2r-cis-1-amino-2-indanol
IUPAC Name (1S,2R)-1-amino-2,3-dihydro-1H-inden-2-ol
InChI Key LOPKSXMQWBYUOI-BDAKNGLRSA-O
Molecular Formula C9H12NO
14

1-Aminoindan, 98%

CAS: 34698-41-4 Molecular Formula: C9H12N Molecular Weight (g/mol): 134.20 MDL Number: MFCD00003799 InChI Key: XJEVHMGJSYVQBQ-VIFPVBQESA-O Synonym: 1-aminoindan,1-aminoindane,1-indanamine,indan-1-ylamine,indanamin,aminoindan,indanylamine,indan-1-amine,1h-inden-1-amine, 2,3-dihydro,2,3-dihydro-1h-inden-1-ylamine PubChem CID: 123445 IUPAC Name: 2,3-dihydro-1H-inden-1-amine SMILES: [NH3+][C@H]1CCC2=CC=CC=C12

PubChem CID 123445
CAS 34698-41-4
Molecular Weight (g/mol) 134.20
MDL Number MFCD00003799
SMILES [NH3+][C@H]1CCC2=CC=CC=C12
Synonym 1-aminoindan,1-aminoindane,1-indanamine,indan-1-ylamine,indanamin,aminoindan,indanylamine,indan-1-amine,1h-inden-1-amine, 2,3-dihydro,2,3-dihydro-1h-inden-1-ylamine
IUPAC Name 2,3-dihydro-1H-inden-1-amine
InChI Key XJEVHMGJSYVQBQ-VIFPVBQESA-O
Molecular Formula C9H12N
15

2-(Trifluoromethoxy)benzylamine, 97%, Thermo Scientific™

CAS: 175205-64-8 Molecular Formula: C8H9F3NO Molecular Weight (g/mol): 192.16 MDL Number: MFCD00085176 InChI Key: FYXMMFFZMQMXCQ-UHFFFAOYSA-O Synonym: 2-trifluoromethoxy benzylamine,2-trifluoromethoxy phenyl methanamine,2-trifluoromethoxybenzylamine,o-trifluoromethoxybenzyl amine,1-2-trifluoromethoxy phenyl methanamine,2-trifluormethoxybenzylamine,benzenemethanamine, 2-trifluoromethoxy,2-trifluoromethoxy phenyl methylamine,pubchem4432 PubChem CID: 2777251 IUPAC Name: [2-(trifluoromethoxy)phenyl]methanamine SMILES: [NH3+]CC1=CC=CC=C1OC(F)(F)F

PubChem CID 2777251
CAS 175205-64-8
Molecular Weight (g/mol) 192.16
MDL Number MFCD00085176
SMILES [NH3+]CC1=CC=CC=C1OC(F)(F)F
Synonym 2-trifluoromethoxy benzylamine,2-trifluoromethoxy phenyl methanamine,2-trifluoromethoxybenzylamine,o-trifluoromethoxybenzyl amine,1-2-trifluoromethoxy phenyl methanamine,2-trifluormethoxybenzylamine,benzenemethanamine, 2-trifluoromethoxy,2-trifluoromethoxy phenyl methylamine,pubchem4432
IUPAC Name [2-(trifluoromethoxy)phenyl]methanamine
InChI Key FYXMMFFZMQMXCQ-UHFFFAOYSA-O
Molecular Formula C8H9F3NO