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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
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alpha-Bromo-p-toluic acid, 97%

CAS: 6232-88-8 Molecular Formula: C8H7BrO2 Molecular Weight (g/mol): 215.05 MDL Number: MFCD00002567 InChI Key: CQQSQBRPAJSTFB-UHFFFAOYSA-N Synonym: 4-bromomethyl benzoic acid,alpha-bromo-p-toluic acid,benzoic acid, 4-bromomethyl,p-bromomethyl benzoic acid,4-carboxybenzyl bromide,4-bromomethyl-benzoic acid,a-bromo-p-toluic acid,p-carboxybenzyl bromide,p-bromomethylbenzoic acid PubChem CID: 22599 IUPAC Name: 4-(bromomethyl)benzoic acid SMILES: C1=CC(=CC=C1CBr)C(=O)O

EDGE
PubChem CID 22599
CAS 6232-88-8
Molecular Weight (g/mol) 215.05
MDL Number MFCD00002567
SMILES C1=CC(=CC=C1CBr)C(=O)O
Synonym 4-bromomethyl benzoic acid,alpha-bromo-p-toluic acid,benzoic acid, 4-bromomethyl,p-bromomethyl benzoic acid,4-carboxybenzyl bromide,4-bromomethyl-benzoic acid,a-bromo-p-toluic acid,p-carboxybenzyl bromide,p-bromomethylbenzoic acid
IUPAC Name 4-(bromomethyl)benzoic acid
InChI Key CQQSQBRPAJSTFB-UHFFFAOYSA-N
Molecular Formula C8H7BrO2
2
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o-Phenylenediacetonitrile, 99+%

CAS: 613-73-0 Molecular Formula: C10H8N2 Molecular Weight (g/mol): 156.19 MDL Number: MFCD00001905 InChI Key: FWPFXBANOKKNBR-UHFFFAOYSA-N Synonym: 1,2-phenylenediacetonitrile,o-phenylenediacetonitrile,1,2-bis cyanomethyl benzene,o-xylylene dicyanide,2-2-cyanomethyl phenyl acetonitrile,o-benzenediacetonitrile,2,2'-1,2-phenylene diacetonitrile,o-bis cyanomethyl benzene,1,2-benzenediacetonitrile,o-benzendiacetonitrile PubChem CID: 69180 IUPAC Name: 2-[2-(cyanomethyl)phenyl]acetonitrile SMILES: N#CCC1=CC=CC=C1CC#N

EDGE
PubChem CID 69180
CAS 613-73-0
Molecular Weight (g/mol) 156.19
MDL Number MFCD00001905
SMILES N#CCC1=CC=CC=C1CC#N
Synonym 1,2-phenylenediacetonitrile,o-phenylenediacetonitrile,1,2-bis cyanomethyl benzene,o-xylylene dicyanide,2-2-cyanomethyl phenyl acetonitrile,o-benzenediacetonitrile,2,2'-1,2-phenylene diacetonitrile,o-bis cyanomethyl benzene,1,2-benzenediacetonitrile,o-benzendiacetonitrile
IUPAC Name 2-[2-(cyanomethyl)phenyl]acetonitrile
InChI Key FWPFXBANOKKNBR-UHFFFAOYSA-N
Molecular Formula C10H8N2
3

4-(Bromomethyl)-3-fluorobenzonitrile 98.0+%, TCI America™

CAS: 105942-09-4 Molecular Formula: C8H5BrFN Molecular Weight (g/mol): 214.04 MDL Number: MFCD07368341 InChI Key: ZESZAIOGACKOMB-UHFFFAOYSA-N Synonym: 4-bromomethyl-3-fluorobenzonitrile,4-cyano-2-fluorobenzyl bromide,2-fluoro-4-cyanobenzyl bromide,2-fluoro-4-cyanbenzyl bromide,benzonitrile, 4-bromomethyl-3-fluoro,2-fluoro-4-cyanobenzylbromide,3-fluoro-4-bromomethyl benzonitrile,4-bromomethyl-3-fluoro-benzonitrile,4-bromomethyl-3-fluorobenzenecarbonitrile,pubchem4907 PubChem CID: 2783149 IUPAC Name: 4-(bromomethyl)-3-fluorobenzonitrile SMILES: FC1=C(CBr)C=CC(=C1)C#N

PubChem CID 2783149
CAS 105942-09-4
Molecular Weight (g/mol) 214.04
MDL Number MFCD07368341
SMILES FC1=C(CBr)C=CC(=C1)C#N
Synonym 4-bromomethyl-3-fluorobenzonitrile,4-cyano-2-fluorobenzyl bromide,2-fluoro-4-cyanobenzyl bromide,2-fluoro-4-cyanbenzyl bromide,benzonitrile, 4-bromomethyl-3-fluoro,2-fluoro-4-cyanobenzylbromide,3-fluoro-4-bromomethyl benzonitrile,4-bromomethyl-3-fluoro-benzonitrile,4-bromomethyl-3-fluorobenzenecarbonitrile,pubchem4907
IUPAC Name 4-(bromomethyl)-3-fluorobenzonitrile
InChI Key ZESZAIOGACKOMB-UHFFFAOYSA-N
Molecular Formula C8H5BrFN
4
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3-Methoxybenzyl chloride, 98+%

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
5
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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
6
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Methyl 3-(bromomethyl)benzoate, 95%

CAS: 1129-28-8 Molecular Formula: C9H9BrO2 Molecular Weight (g/mol): 229.07 MDL Number: MFCD00051437 InChI Key: YUHSMQQNPRLEEJ-UHFFFAOYSA-N Synonym: methyl 3-bromomethyl benzoate,m-carbomethoxybenzyl bromide,3-bromomethyl benzoic acid methyl ester,benzoic acid, 3-bromomethyl-, methyl ester,methyl-3-bromomethylbenzoate,methyl alpha-bromo-m-toluate,methyl3-bromomethyl benzoate,methyl-3-bromomethyl benzoate,3-carbomethoxybenzyl bromide PubChem CID: 517981 IUPAC Name: methyl 3-(bromomethyl)benzoate SMILES: COC(=O)C1=CC=CC(CBr)=C1

PubChem CID 517981
CAS 1129-28-8
Molecular Weight (g/mol) 229.07
MDL Number MFCD00051437
SMILES COC(=O)C1=CC=CC(CBr)=C1
Synonym methyl 3-bromomethyl benzoate,m-carbomethoxybenzyl bromide,3-bromomethyl benzoic acid methyl ester,benzoic acid, 3-bromomethyl-, methyl ester,methyl-3-bromomethylbenzoate,methyl alpha-bromo-m-toluate,methyl3-bromomethyl benzoate,methyl-3-bromomethyl benzoate,3-carbomethoxybenzyl bromide
IUPAC Name methyl 3-(bromomethyl)benzoate
InChI Key YUHSMQQNPRLEEJ-UHFFFAOYSA-N
Molecular Formula C9H9BrO2
7
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DL-alpha-Methoxyphenylacetic acid, 99%

CAS: 7021-09-2 Molecular Formula: C9H10O3 Molecular Weight (g/mol): 166.18 InChI Key: DIWVBIXQCNRCFE-UHFFFAOYNA-N Synonym: methoxyphenylacetic acid,methoxy phenyl acetic acid,dl-alpha-methoxyphenylacetic acid,acetic acid, methoxyphenyl,alpha-methoxyphenylacetic acid,o-methyl-dl-mandelic acid,benzeneacetic acid, .alpha.-methoxy,2-methoxy-2-phenyl-acetic acid,methyloxy phenyl acetic acid,.alpha.-methoxyphenylacetic acid PubChem CID: 107202 IUPAC Name: 2-methoxy-2-phenylacetic acid SMILES: COC(C1=CC=CC=C1)C(=O)O

PubChem CID 107202
CAS 7021-09-2
Molecular Weight (g/mol) 166.18
SMILES COC(C1=CC=CC=C1)C(=O)O
Synonym methoxyphenylacetic acid,methoxy phenyl acetic acid,dl-alpha-methoxyphenylacetic acid,acetic acid, methoxyphenyl,alpha-methoxyphenylacetic acid,o-methyl-dl-mandelic acid,benzeneacetic acid, .alpha.-methoxy,2-methoxy-2-phenyl-acetic acid,methyloxy phenyl acetic acid,.alpha.-methoxyphenylacetic acid
IUPAC Name 2-methoxy-2-phenylacetic acid
InChI Key DIWVBIXQCNRCFE-UHFFFAOYNA-N
Molecular Formula C9H10O3
8
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4-Bromomethyl-3-fluorobenzonitrile, 95%, Thermo Scientific Chemicals

CAS: 105942-09-4 Molecular Formula: C8H5BrFN Molecular Weight (g/mol): 214.04 MDL Number: MFCD07368341 InChI Key: ZESZAIOGACKOMB-UHFFFAOYSA-N Synonym: 4-bromomethyl-3-fluorobenzonitrile,4-cyano-2-fluorobenzyl bromide,2-fluoro-4-cyanobenzyl bromide,2-fluoro-4-cyanbenzyl bromide,benzonitrile, 4-bromomethyl-3-fluoro,2-fluoro-4-cyanobenzylbromide,3-fluoro-4-bromomethyl benzonitrile,4-bromomethyl-3-fluoro-benzonitrile,4-bromomethyl-3-fluorobenzenecarbonitrile,pubchem4907 PubChem CID: 2783149 IUPAC Name: 4-(bromomethyl)-3-fluorobenzonitrile SMILES: FC1=C(CBr)C=CC(=C1)C#N

PubChem CID 2783149
CAS 105942-09-4
Molecular Weight (g/mol) 214.04
MDL Number MFCD07368341
SMILES FC1=C(CBr)C=CC(=C1)C#N
Synonym 4-bromomethyl-3-fluorobenzonitrile,4-cyano-2-fluorobenzyl bromide,2-fluoro-4-cyanobenzyl bromide,2-fluoro-4-cyanbenzyl bromide,benzonitrile, 4-bromomethyl-3-fluoro,2-fluoro-4-cyanobenzylbromide,3-fluoro-4-bromomethyl benzonitrile,4-bromomethyl-3-fluoro-benzonitrile,4-bromomethyl-3-fluorobenzenecarbonitrile,pubchem4907
IUPAC Name 4-(bromomethyl)-3-fluorobenzonitrile
InChI Key ZESZAIOGACKOMB-UHFFFAOYSA-N
Molecular Formula C8H5BrFN
9

[3-(1-Methyl-1H-pyrazol-3-yl)phenyl]methanol, 90%, Thermo Scientific™

CAS: 910037-09-1 Molecular Formula: C11H12N2O Molecular Weight (g/mol): 188.23 MDL Number: MFCD09065007 InChI Key: IFFXGZCJGGVFOF-UHFFFAOYSA-N Synonym: 3-1-methyl-1h-pyrazol-3-yl phenyl methanol,3-1-methylpyrazol-3-yl phenyl methanol,3-1-methylpyrazol-3-yl phenyl methan-1-ol PubChem CID: 24229630 IUPAC Name: [3-(1-methylpyrazol-3-yl)phenyl]methanol SMILES: CN1C=CC(=N1)C2=CC(=CC=C2)CO

PubChem CID 24229630
CAS 910037-09-1
Molecular Weight (g/mol) 188.23
MDL Number MFCD09065007
SMILES CN1C=CC(=N1)C2=CC(=CC=C2)CO
Synonym 3-1-methyl-1h-pyrazol-3-yl phenyl methanol,3-1-methylpyrazol-3-yl phenyl methanol,3-1-methylpyrazol-3-yl phenyl methan-1-ol
IUPAC Name [3-(1-methylpyrazol-3-yl)phenyl]methanol
InChI Key IFFXGZCJGGVFOF-UHFFFAOYSA-N
Molecular Formula C11H12N2O
10
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2-Fluoro-4-methoxybenzyl alcohol, 97%

CAS: 405-09-4 Molecular Formula: C8H9FO2 Molecular Weight (g/mol): 156.16 MDL Number: MFCD04116336 InChI Key: AZYGOIQKPGPBTM-UHFFFAOYSA-N Synonym: 2-fluoro-4-methoxyphenyl methanol,2-fluoro-4-methoxybenzyl alcohol,2-fluoro-p-anisyl alcohol,3-fluoro-4-hydroxymethyl anisole,benzenemethanol,2-fluoro-4-methoxy,2-fluoro-4-methoxyphenyl methan-1-ol,benzyl alcohol, 4-methoxy-6-fluoro,pubchem7733,2-fluoro-4-methoxybenzylalcohol,rarechem al bd 0456 PubChem CID: 593638 IUPAC Name: (2-fluoro-4-methoxyphenyl)methanol SMILES: COC1=CC(F)=C(CO)C=C1

PubChem CID 593638
CAS 405-09-4
Molecular Weight (g/mol) 156.16
MDL Number MFCD04116336
SMILES COC1=CC(F)=C(CO)C=C1
Synonym 2-fluoro-4-methoxyphenyl methanol,2-fluoro-4-methoxybenzyl alcohol,2-fluoro-p-anisyl alcohol,3-fluoro-4-hydroxymethyl anisole,benzenemethanol,2-fluoro-4-methoxy,2-fluoro-4-methoxyphenyl methan-1-ol,benzyl alcohol, 4-methoxy-6-fluoro,pubchem7733,2-fluoro-4-methoxybenzylalcohol,rarechem al bd 0456
IUPAC Name (2-fluoro-4-methoxyphenyl)methanol
InChI Key AZYGOIQKPGPBTM-UHFFFAOYSA-N
Molecular Formula C8H9FO2
11
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alpha-Bromo-m-tolunitrile, 95%

CAS: 28188-41-2 Molecular Formula: C8H6BrN Molecular Weight (g/mol): 196.05 MDL Number: MFCD00001809 InChI Key: CVKOOKPNCVYHNY-UHFFFAOYSA-N Synonym: 3-bromomethyl benzonitrile,3-cyanobenzyl bromide,alpha-bromo-m-tolunitrile,m-cyanobenzyl bromide,benzonitrile, 3-bromomethyl,m-bromomethyl benzonitrile,alpha-bromo-m-toluonitrile,m-tolunitrile, .alpha.-bromo,a-bromo-m-tolunitrile,3-bromomethyl-benzonitrile PubChem CID: 97249 IUPAC Name: 3-(bromomethyl)benzonitrile SMILES: BrCC1=CC=CC(=C1)C#N

PubChem CID 97249
CAS 28188-41-2
Molecular Weight (g/mol) 196.05
MDL Number MFCD00001809
SMILES BrCC1=CC=CC(=C1)C#N
Synonym 3-bromomethyl benzonitrile,3-cyanobenzyl bromide,alpha-bromo-m-tolunitrile,m-cyanobenzyl bromide,benzonitrile, 3-bromomethyl,m-bromomethyl benzonitrile,alpha-bromo-m-toluonitrile,m-tolunitrile, .alpha.-bromo,a-bromo-m-tolunitrile,3-bromomethyl-benzonitrile
IUPAC Name 3-(bromomethyl)benzonitrile
InChI Key CVKOOKPNCVYHNY-UHFFFAOYSA-N
Molecular Formula C8H6BrN
12
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4-Methylbenzyl cyanide, 98%

CAS: 2947-61-7 Molecular Formula: C9H9N Molecular Weight (g/mol): 131.18 MDL Number: MFCD00001922 InChI Key: RNHKXHKUKJXLAU-UHFFFAOYSA-N Synonym: 4-methylbenzyl cyanide,4-methylphenylacetonitrile,p-tolylacetonitrile,p-methylbenzyl cyanide,2-4-methylphenyl acetonitrile,benzeneacetonitrile, 4-methyl,4-methylphenyl acetonitrile,4-methylbenzeneacetonitrile,4-methylbenzylcyanide,2-p-tolylacetonitrile PubChem CID: 76280 IUPAC Name: 2-(4-methylphenyl)acetonitrile SMILES: CC1=CC=C(CC#N)C=C1

PubChem CID 76280
CAS 2947-61-7
Molecular Weight (g/mol) 131.18
MDL Number MFCD00001922
SMILES CC1=CC=C(CC#N)C=C1
Synonym 4-methylbenzyl cyanide,4-methylphenylacetonitrile,p-tolylacetonitrile,p-methylbenzyl cyanide,2-4-methylphenyl acetonitrile,benzeneacetonitrile, 4-methyl,4-methylphenyl acetonitrile,4-methylbenzeneacetonitrile,4-methylbenzylcyanide,2-p-tolylacetonitrile
IUPAC Name 2-(4-methylphenyl)acetonitrile
InChI Key RNHKXHKUKJXLAU-UHFFFAOYSA-N
Molecular Formula C9H9N
13
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alpha-Cyano-o-tolunitrile, 80%, Thermo Scientific™

CAS: 3759-28-2 Molecular Formula: C9H6N2 Molecular Weight (g/mol): 142.16 MDL Number: MFCD00001895 InChI Key: GKHSEDFDYXZGCG-UHFFFAOYSA-N Synonym: 2-cyanomethyl benzonitrile,homophthalonitrile,2-cyanobenzyl cyanide,2-cyanophenylacetonitrile,alpha-cyano-o-tolunitrile,o-cyanobenzyl cyanide,benzeneacetonitrile, 2-cyano,2-cyanobenzeneacetonitrile,o-cyanophenyl acetonitrile,o-tolunitrile, alpha-cyano PubChem CID: 77368 IUPAC Name: 2-(cyanomethyl)benzonitrile SMILES: N#CCC1=CC=CC=C1C#N

PubChem CID 77368
CAS 3759-28-2
Molecular Weight (g/mol) 142.16
MDL Number MFCD00001895
SMILES N#CCC1=CC=CC=C1C#N
Synonym 2-cyanomethyl benzonitrile,homophthalonitrile,2-cyanobenzyl cyanide,2-cyanophenylacetonitrile,alpha-cyano-o-tolunitrile,o-cyanobenzyl cyanide,benzeneacetonitrile, 2-cyano,2-cyanobenzeneacetonitrile,o-cyanophenyl acetonitrile,o-tolunitrile, alpha-cyano
IUPAC Name 2-(cyanomethyl)benzonitrile
InChI Key GKHSEDFDYXZGCG-UHFFFAOYSA-N
Molecular Formula C9H6N2
14
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alpha-Bromo-p-tolunitrile, 98%

CAS: 17201-43-3 Molecular Formula: C8H6BrN Molecular Weight (g/mol): 196.05 MDL Number: MFCD00001829 InChI Key: UMLFTCYAQPPZER-UHFFFAOYSA-N Synonym: 4-cyanobenzyl bromide,4-bromomethyl benzonitrile,p-cyanobenzyl bromide,alpha-bromo-p-tolunitrile,benzonitrile, 4-bromomethyl,4-bromomethyl-benzonitrile,alpha-bromo-p-toluonitrile,p-bromomethyl benzonitrile,4-cyano benzyl bromide,benzonitrile, p-bromomethyl PubChem CID: 86996 IUPAC Name: 4-(bromomethyl)benzonitrile SMILES: C1=CC(=CC=C1CBr)C#N

PubChem CID 86996
CAS 17201-43-3
Molecular Weight (g/mol) 196.05
MDL Number MFCD00001829
SMILES C1=CC(=CC=C1CBr)C#N
Synonym 4-cyanobenzyl bromide,4-bromomethyl benzonitrile,p-cyanobenzyl bromide,alpha-bromo-p-tolunitrile,benzonitrile, 4-bromomethyl,4-bromomethyl-benzonitrile,alpha-bromo-p-toluonitrile,p-bromomethyl benzonitrile,4-cyano benzyl bromide,benzonitrile, p-bromomethyl
IUPAC Name 4-(bromomethyl)benzonitrile
InChI Key UMLFTCYAQPPZER-UHFFFAOYSA-N
Molecular Formula C8H6BrN
15

(±)-α-Methoxyphenylacetic acid, Solstice

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