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Benzyl Derivatives

Organic compounds that are derived from compounds that contain a benzene ring attached to a CH2 group, and have the following structure: C6H5CH2–.

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1

Miconazole Impurity I, TRC

CAS: 47363-37-1 Molecular Formula: C18 H15 Cl3 N2 O Molecular Weight (g/mol): 381.683 Synonym: 1-[2-[(2-Chlorophenyl)methoxy]-2-(2,4-dichlorophenyl)ethyl]-1H-Imidazole,Miconazole EP Impurity I IUPAC Name: 1-[2-[(2-chlorophenyl)methoxy]-2-(2,4-dichlorophenyl)ethyl]imidazole SMILES: Clc1ccc(C(Cn2ccnc2)OCc3ccccc3Cl)c(Cl)c1

CAS 47363-37-1
Molecular Weight (g/mol) 381.683
SMILES Clc1ccc(C(Cn2ccnc2)OCc3ccccc3Cl)c(Cl)c1
Synonym 1-[2-[(2-Chlorophenyl)methoxy]-2-(2,4-dichlorophenyl)ethyl]-1H-Imidazole,Miconazole EP Impurity I
IUPAC Name 1-[2-[(2-chlorophenyl)methoxy]-2-(2,4-dichlorophenyl)ethyl]imidazole
Molecular Formula C18 H15 Cl3 N2 O
2

3-Iodobenzyl bromide, 97%

CAS: 49617-83-6 Molecular Formula: C7H6BrI Molecular Weight (g/mol): 296.93 MDL Number: MFCD00019016 InChI Key: BACZSVQZBSCWIG-UHFFFAOYSA-N Synonym: 3-iodobenzyl bromide,1-bromomethyl-3-iodobenzene,alpha-bromo-3-iodotoluene,3-iodobenzylbromide,m-iodobenzyl bromide,benzene, 1-bromomethyl-3-iodo,m-iodobenzylbromide,3-iodo-benzylbromide,3-iodo-benzyl bromide,meta-iodobenzyl bromide PubChem CID: 2759361 IUPAC Name: 1-(bromomethyl)-3-iodobenzene SMILES: C1=CC(=CC(=C1)I)CBr

PubChem CID 2759361
CAS 49617-83-6
Molecular Weight (g/mol) 296.93
MDL Number MFCD00019016
SMILES C1=CC(=CC(=C1)I)CBr
Synonym 3-iodobenzyl bromide,1-bromomethyl-3-iodobenzene,alpha-bromo-3-iodotoluene,3-iodobenzylbromide,m-iodobenzyl bromide,benzene, 1-bromomethyl-3-iodo,m-iodobenzylbromide,3-iodo-benzylbromide,3-iodo-benzyl bromide,meta-iodobenzyl bromide
IUPAC Name 1-(bromomethyl)-3-iodobenzene
InChI Key BACZSVQZBSCWIG-UHFFFAOYSA-N
Molecular Formula C7H6BrI
3

alpha-Bromo-4-nitro-o-cresol, 95%

CAS: 772-33-8 MDL Number: MFCD00007340 InChI Key: KFDPCYZHENQOBV-UHFFFAOYSA-N Synonym: 2-hydroxy-5-nitrobenzyl bromide,2-bromomethyl-4-nitrophenol,alpha-bromo-4-nitro-o-cresol,phenol, 2-bromomethyl-4-nitro,koshland reagent i,2-bromomethyl-4-nitro-phenol,2-hydroxy-5-nitrobenzylbromide,.alpha.-bromo-4-nitro-o-cresol,o-cresol, .alpha.-bromo-4-nitro,koshland i PubChem CID: 13044 IUPAC Name: 2-(bromomethyl)-4-nitrophenol SMILES: C1=CC(=C(C=C1[N+](=O)[O-])CBr)O

PubChem CID 13044
CAS 772-33-8
MDL Number MFCD00007340
SMILES C1=CC(=C(C=C1[N+](=O)[O-])CBr)O
Synonym 2-hydroxy-5-nitrobenzyl bromide,2-bromomethyl-4-nitrophenol,alpha-bromo-4-nitro-o-cresol,phenol, 2-bromomethyl-4-nitro,koshland reagent i,2-bromomethyl-4-nitro-phenol,2-hydroxy-5-nitrobenzylbromide,.alpha.-bromo-4-nitro-o-cresol,o-cresol, .alpha.-bromo-4-nitro,koshland i
IUPAC Name 2-(bromomethyl)-4-nitrophenol
InChI Key KFDPCYZHENQOBV-UHFFFAOYSA-N
4

2-Iodobenzyl alcohol, 98+%

CAS: 5159-41-1 Molecular Formula: C7H7IO Molecular Weight (g/mol): 234.036 MDL Number: MFCD00004610 InChI Key: WZCXOBMFBKSSFA-UHFFFAOYSA-N Synonym: 2-iodobenzyl alcohol,2-iodophenyl methanol,o-iodobenzyl alcohol,2-iodobenzylalcohol,benzenemethanol, 2-iodo,2-iodobenzylic alcohol,2-jod-benzylalkohol,o-iodo benzylalcohol,2-iodo-benzyl alcohol PubChem CID: 107629 IUPAC Name: (2-iodophenyl)methanol SMILES: C1=CC=C(C(=C1)CO)I

PubChem CID 107629
CAS 5159-41-1
Molecular Weight (g/mol) 234.036
MDL Number MFCD00004610
SMILES C1=CC=C(C(=C1)CO)I
Synonym 2-iodobenzyl alcohol,2-iodophenyl methanol,o-iodobenzyl alcohol,2-iodobenzylalcohol,benzenemethanol, 2-iodo,2-iodobenzylic alcohol,2-jod-benzylalkohol,o-iodo benzylalcohol,2-iodo-benzyl alcohol
IUPAC Name (2-iodophenyl)methanol
InChI Key WZCXOBMFBKSSFA-UHFFFAOYSA-N
Molecular Formula C7H7IO
5

Bromodiiodomethane (>85%), TRC

CAS: 557-95-9 Molecular Formula: C H Br I2 Molecular Weight (g/mol): 346.73 Synonym: Bromodiiodomethane,Diiodobromomethane IUPAC Name: bromo(diiodo)methane SMILES: BrC(I)I

CAS 557-95-9
Molecular Weight (g/mol) 346.73
SMILES BrC(I)I
Synonym Bromodiiodomethane,Diiodobromomethane
IUPAC Name bromo(diiodo)methane
Molecular Formula C H Br I2
6

2,4-Dimethoxybenzyl alcohol, 99%

CAS: 7314-44-5 Molecular Formula: C9H12O3 Molecular Weight (g/mol): 168.19 MDL Number: MFCD00004614 InChI Key: RNKOUSCCPHSCFE-UHFFFAOYSA-N Synonym: 2,4-dimethoxybenzyl alcohol,2,4-dimethoxyphenyl methanol,benzenemethanol, 2,4-dimethoxy,2,4-dimethoxybenzylalcohol,1-hydroxymethyl-2,4-dimethoxybenzene,2,4-dimethoxyphenyl methan-1-ol,pubchem7454,acmc-209opp,2,4-dimethoxy-benzylalcohol,2,4-dimethoxybenzyl-alcohol PubChem CID: 81750 IUPAC Name: (2,4-dimethoxyphenyl)methanol SMILES: COC1=CC(=C(C=C1)CO)OC

PubChem CID 81750
CAS 7314-44-5
Molecular Weight (g/mol) 168.19
MDL Number MFCD00004614
SMILES COC1=CC(=C(C=C1)CO)OC
Synonym 2,4-dimethoxybenzyl alcohol,2,4-dimethoxyphenyl methanol,benzenemethanol, 2,4-dimethoxy,2,4-dimethoxybenzylalcohol,1-hydroxymethyl-2,4-dimethoxybenzene,2,4-dimethoxyphenyl methan-1-ol,pubchem7454,acmc-209opp,2,4-dimethoxy-benzylalcohol,2,4-dimethoxybenzyl-alcohol
IUPAC Name (2,4-dimethoxyphenyl)methanol
InChI Key RNKOUSCCPHSCFE-UHFFFAOYSA-N
Molecular Formula C9H12O3
7

4-Iodobenzyl alcohol, 97%

CAS: 18282-51-4 Molecular Formula: C7H7IO Molecular Weight (g/mol): 234.036 MDL Number: MFCD01732720 InChI Key: CNQRHSZYVFYOIE-UHFFFAOYSA-N Synonym: 4-iodobenzyl alcohol,4-iodophenyl methanol,p-iodobenzyl alcohol,benzenemethanol, 4-iodo,benzyl alcohol, p-iodo,4-iodobenzylalcohol,p-iodobenzylalcohol,4-iodobenzyl-alcohol,4-iodobenzyl zlcohol,p-lodo-benzyl alcohol PubChem CID: 29012 IUPAC Name: (4-iodophenyl)methanol SMILES: C1=CC(=CC=C1CO)I

PubChem CID 29012
CAS 18282-51-4
Molecular Weight (g/mol) 234.036
MDL Number MFCD01732720
SMILES C1=CC(=CC=C1CO)I
Synonym 4-iodobenzyl alcohol,4-iodophenyl methanol,p-iodobenzyl alcohol,benzenemethanol, 4-iodo,benzyl alcohol, p-iodo,4-iodobenzylalcohol,p-iodobenzylalcohol,4-iodobenzyl-alcohol,4-iodobenzyl zlcohol,p-lodo-benzyl alcohol
IUPAC Name (4-iodophenyl)methanol
InChI Key CNQRHSZYVFYOIE-UHFFFAOYSA-N
Molecular Formula C7H7IO
8

4-Iodophenylacetonitrile, 97%

CAS: 51628-12-7 Molecular Formula: C8H6IN Molecular Weight (g/mol): 243.047 MDL Number: MFCD00060306 InChI Key: PNXWQTYSBFGIFD-UHFFFAOYSA-N Synonym: 4-iodophenylacetonitrile,2-4-iodophenyl acetonitrile,4-iodobenzyl cyanide,4-iodophenyl acetonitrile,benzeneacetonitrile, 4-iodo,p-iodobenzylcyanide,pubchem19992,acmc-1asuk,4-cyanomethyl phenyl iodide,4-iodo-phenyl-acetonitrile PubChem CID: 142866 IUPAC Name: 2-(4-iodophenyl)acetonitrile SMILES: C1=CC(=CC=C1CC#N)I

PubChem CID 142866
CAS 51628-12-7
Molecular Weight (g/mol) 243.047
MDL Number MFCD00060306
SMILES C1=CC(=CC=C1CC#N)I
Synonym 4-iodophenylacetonitrile,2-4-iodophenyl acetonitrile,4-iodobenzyl cyanide,4-iodophenyl acetonitrile,benzeneacetonitrile, 4-iodo,p-iodobenzylcyanide,pubchem19992,acmc-1asuk,4-cyanomethyl phenyl iodide,4-iodo-phenyl-acetonitrile
IUPAC Name 2-(4-iodophenyl)acetonitrile
InChI Key PNXWQTYSBFGIFD-UHFFFAOYSA-N
Molecular Formula C8H6IN
9

2-Iodophenylacetonitrile, 96%

CAS: 40400-15-5 Molecular Formula: C8H6IN Molecular Weight (g/mol): 243.047 MDL Number: MFCD00040888 InChI Key: FPSGTRJUQLYLHE-UHFFFAOYSA-N Synonym: 2-iodophenylacetonitrile,2-2-iodophenyl acetonitrile,2-iodobenzyl cyanide,o-iodophenylacetonitrile,benzeneacetonitrile, 2-iodo,o-iodobenzyl cyanide,acmc-20a7xu,2-iodo-phenylacetonitrile,2-iodo-phenyl-acetonitrile,2-2-iodophenyl ethanenitrile PubChem CID: 4402282 IUPAC Name: 2-(2-iodophenyl)acetonitrile SMILES: C1=CC=C(C(=C1)CC#N)I

PubChem CID 4402282
CAS 40400-15-5
Molecular Weight (g/mol) 243.047
MDL Number MFCD00040888
SMILES C1=CC=C(C(=C1)CC#N)I
Synonym 2-iodophenylacetonitrile,2-2-iodophenyl acetonitrile,2-iodobenzyl cyanide,o-iodophenylacetonitrile,benzeneacetonitrile, 2-iodo,o-iodobenzyl cyanide,acmc-20a7xu,2-iodo-phenylacetonitrile,2-iodo-phenyl-acetonitrile,2-2-iodophenyl ethanenitrile
IUPAC Name 2-(2-iodophenyl)acetonitrile
InChI Key FPSGTRJUQLYLHE-UHFFFAOYSA-N
Molecular Formula C8H6IN
10

(S)-(+)-alpha-Methoxyphenylacetic acid, 98%

CAS: 26164-26-1 Molecular Formula: C9H10O3 Molecular Weight (g/mol): 166.18 MDL Number: MFCD00064216 InChI Key: DIWVBIXQCNRCFE-QMMMGPOBSA-N Synonym: s-+-alpha-methoxyphenylacetic acid,s-2-methoxy-2-phenylacetic acid,s-methoxyphenylacetic acid,s-alpha-methoxyphenylacetic acid,s-+-methoxyphenylacetic acid,2s-2-methoxy-2-phenylacetic acid,s-methoxy phenyl acetic acid,s---alpha-methoxyphenylacetic acid,methoxy phenyl acetic acid #,benzeneacetic acid, .alpha.-methoxy-, s PubChem CID: 643325 IUPAC Name: (2S)-2-methoxy-2-phenylacetic acid SMILES: COC(C1=CC=CC=C1)C(=O)O

PubChem CID 643325
CAS 26164-26-1
Molecular Weight (g/mol) 166.18
MDL Number MFCD00064216
SMILES COC(C1=CC=CC=C1)C(=O)O
Synonym s-+-alpha-methoxyphenylacetic acid,s-2-methoxy-2-phenylacetic acid,s-methoxyphenylacetic acid,s-alpha-methoxyphenylacetic acid,s-+-methoxyphenylacetic acid,2s-2-methoxy-2-phenylacetic acid,s-methoxy phenyl acetic acid,s---alpha-methoxyphenylacetic acid,methoxy phenyl acetic acid #,benzeneacetic acid, .alpha.-methoxy-, s
IUPAC Name (2S)-2-methoxy-2-phenylacetic acid
InChI Key DIWVBIXQCNRCFE-QMMMGPOBSA-N
Molecular Formula C9H10O3
11

3-Bromophenylacetonitrile, 97%

CAS: 31938-07-5 Molecular Formula: C8H6BrN Molecular Weight (g/mol): 196.047 MDL Number: MFCD00001906 InChI Key: UUZYFBXKWIQKTF-UHFFFAOYSA-N Synonym: 3-bromophenylacetonitrile,3-bromobenzyl cyanide,2-3-bromophenyl acetonitrile,m-bromobenzyl cyanide,benzeneacetonitrile, 3-bromo,3-bromobenzylcyanide,3-bromobenzeneacetonitrile,3-bromophenyl acetonitrile,m-bromophenylacetonitrile,2-3-bromophenyl ethanenitrile PubChem CID: 36023 IUPAC Name: 2-(3-bromophenyl)acetonitrile SMILES: C1=CC(=CC(=C1)Br)CC#N

PubChem CID 36023
CAS 31938-07-5
Molecular Weight (g/mol) 196.047
MDL Number MFCD00001906
SMILES C1=CC(=CC(=C1)Br)CC#N
Synonym 3-bromophenylacetonitrile,3-bromobenzyl cyanide,2-3-bromophenyl acetonitrile,m-bromobenzyl cyanide,benzeneacetonitrile, 3-bromo,3-bromobenzylcyanide,3-bromobenzeneacetonitrile,3-bromophenyl acetonitrile,m-bromophenylacetonitrile,2-3-bromophenyl ethanenitrile
IUPAC Name 2-(3-bromophenyl)acetonitrile
InChI Key UUZYFBXKWIQKTF-UHFFFAOYSA-N
Molecular Formula C8H6BrN
12

4-Iodobenzyl bromide, 97%

CAS: 16004-15-2 Molecular Formula: C7H6BrI Molecular Weight (g/mol): 296.933 MDL Number: MFCD00209656 InChI Key: BQTRMYJYYNQQGK-UHFFFAOYSA-N Synonym: 4-iodobenzyl bromide,1-bromomethyl-4-iodobenzene,4-iodobenzylbromide,p-iodobenzyl bromide,1-bromomethyl-4-iodo-benzene,alpha-bromo-4-iodotoluene,4-bromomethyl-1-iodobenzene,benzene, 1-bromomethyl-4-iodo,4-iodo benzyl bromide PubChem CID: 954258 IUPAC Name: 1-(bromomethyl)-4-iodobenzene SMILES: C1=CC(=CC=C1CBr)I

PubChem CID 954258
CAS 16004-15-2
Molecular Weight (g/mol) 296.933
MDL Number MFCD00209656
SMILES C1=CC(=CC=C1CBr)I
Synonym 4-iodobenzyl bromide,1-bromomethyl-4-iodobenzene,4-iodobenzylbromide,p-iodobenzyl bromide,1-bromomethyl-4-iodo-benzene,alpha-bromo-4-iodotoluene,4-bromomethyl-1-iodobenzene,benzene, 1-bromomethyl-4-iodo,4-iodo benzyl bromide
IUPAC Name 1-(bromomethyl)-4-iodobenzene
InChI Key BQTRMYJYYNQQGK-UHFFFAOYSA-N
Molecular Formula C7H6BrI
13

3-Iodobenzyl bromide, 96%

CAS: 49617-83-6 Molecular Formula: C7H6BrI Molecular Weight (g/mol): 296.933 MDL Number: MFCD00019016 InChI Key: BACZSVQZBSCWIG-UHFFFAOYSA-N Synonym: 3-iodobenzyl bromide,1-bromomethyl-3-iodobenzene,alpha-bromo-3-iodotoluene,3-iodobenzylbromide,m-iodobenzyl bromide,benzene, 1-bromomethyl-3-iodo,m-iodobenzylbromide,3-iodo-benzylbromide,3-iodo-benzyl bromide,meta-iodobenzyl bromide PubChem CID: 2759361 IUPAC Name: 1-(bromomethyl)-3-iodobenzene SMILES: C1=CC(=CC(=C1)I)CBr

PubChem CID 2759361
CAS 49617-83-6
Molecular Weight (g/mol) 296.933
MDL Number MFCD00019016
SMILES C1=CC(=CC(=C1)I)CBr
Synonym 3-iodobenzyl bromide,1-bromomethyl-3-iodobenzene,alpha-bromo-3-iodotoluene,3-iodobenzylbromide,m-iodobenzyl bromide,benzene, 1-bromomethyl-3-iodo,m-iodobenzylbromide,3-iodo-benzylbromide,3-iodo-benzyl bromide,meta-iodobenzyl bromide
IUPAC Name 1-(bromomethyl)-3-iodobenzene
InChI Key BACZSVQZBSCWIG-UHFFFAOYSA-N
Molecular Formula C7H6BrI
14

2-Bromophenylacetonitrile, 97%

CAS: 19472-74-3 Molecular Formula: C8H6BrN Molecular Weight (g/mol): 196.05 MDL Number: MFCD00001896 InChI Key: BVCOJESIQPNOIF-UHFFFAOYSA-N Synonym: 2-bromophenylacetonitrile,2-bromobenzyl cyanide,2-2-bromophenyl acetonitrile,o-bromobenzyl cyanide,2-bromophenyl acetonitrile,o-bromophenylacetonitrile,benzeneacetonitrile, bromo,2-2-bromophenyl ethanenitrile,benzeneacetonitrile, 2-bromo,2-bromo-phenyl-acetonitrile PubChem CID: 29625 IUPAC Name: 2-(2-bromophenyl)acetonitrile SMILES: BrC1=CC=CC=C1CC#N

PubChem CID 29625
CAS 19472-74-3
Molecular Weight (g/mol) 196.05
MDL Number MFCD00001896
SMILES BrC1=CC=CC=C1CC#N
Synonym 2-bromophenylacetonitrile,2-bromobenzyl cyanide,2-2-bromophenyl acetonitrile,o-bromobenzyl cyanide,2-bromophenyl acetonitrile,o-bromophenylacetonitrile,benzeneacetonitrile, bromo,2-2-bromophenyl ethanenitrile,benzeneacetonitrile, 2-bromo,2-bromo-phenyl-acetonitrile
IUPAC Name 2-(2-bromophenyl)acetonitrile
InChI Key BVCOJESIQPNOIF-UHFFFAOYSA-N
Molecular Formula C8H6BrN
15

3-Methoxybenzyl chloride, 97%

CAS: 824-98-6 Molecular Formula: C8H9ClO Molecular Weight (g/mol): 156.61 MDL Number: MFCD00000907 InChI Key: VGISFWWEOGVMED-UHFFFAOYSA-N Synonym: 3-methoxybenzyl chloride,1-chloromethyl-3-methoxybenzene,m-methoxybenzyl chloride,m-chloromethyl anisole,benzene, 1-chloromethyl-3-methoxy,anisole, m-chloromethyl,3-methoxybenzylchloride,3-chloromethyl anisole,3-methoxy benzyl chloride,benzyl chloride,3-methoxy PubChem CID: 69994 IUPAC Name: 1-(chloromethyl)-3-methoxybenzene SMILES: COC1=CC=CC(CCl)=C1

PubChem CID 69994
CAS 824-98-6
Molecular Weight (g/mol) 156.61
MDL Number MFCD00000907
SMILES COC1=CC=CC(CCl)=C1
Synonym 3-methoxybenzyl chloride,1-chloromethyl-3-methoxybenzene,m-methoxybenzyl chloride,m-chloromethyl anisole,benzene, 1-chloromethyl-3-methoxy,anisole, m-chloromethyl,3-methoxybenzylchloride,3-chloromethyl anisole,3-methoxy benzyl chloride,benzyl chloride,3-methoxy
IUPAC Name 1-(chloromethyl)-3-methoxybenzene
InChI Key VGISFWWEOGVMED-UHFFFAOYSA-N
Molecular Formula C8H9ClO