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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Benzyl Alcohol (Certified ACS), Fisher Chemical™

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

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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

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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

1-[4-(Bromomethyl)phenyl]-1H-1,2,4-triazole, 97%, Thermo Scientific™

CAS: 58419-69-5 Molecular Formula: C9H8BrN3 Molecular Weight (g/mol): 238.088 MDL Number: MFCD04113600 InChI Key: NOUAEJFAVOHNSY-UHFFFAOYSA-N Synonym: 1-4-bromomethyl phenyl-1h-1,2,4-triazole,1-4-bromomethyl phenyl-1,2,4-triazole,1h-1,2,4-triazole, 1-4-bromomethyl phenyl,1-4-bromomethylphenyl-1h-1,2,4-triazole,zlchem 1040,1-4-bromomethyl phenyl-1h-1,2,4-triazol,1-4-bromomethyl-phenyl-1h-1,2,4-triazole,1-4-bromo-methyl phenyl-1h-1,2,4-triazole PubChem CID: 2776489 IUPAC Name: 1-[4-(bromomethyl)phenyl]-1,2,4-triazole SMILES: C1=CC(=CC=C1CBr)N2C=NC=N2

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PubChem CID	2776489
CAS	58419-69-5
Molecular Weight (g/mol)	238.088
MDL Number	MFCD04113600
SMILES	C1=CC(=CC=C1CBr)N2C=NC=N2
Synonym	1-4-bromomethyl phenyl-1h-1,2,4-triazole,1-4-bromomethyl phenyl-1,2,4-triazole,1h-1,2,4-triazole, 1-4-bromomethyl phenyl,1-4-bromomethylphenyl-1h-1,2,4-triazole,zlchem 1040,1-4-bromomethyl phenyl-1h-1,2,4-triazol,1-4-bromomethyl-phenyl-1h-1,2,4-triazole,1-4-bromo-methyl phenyl-1h-1,2,4-triazole
IUPAC Name	1-[4-(bromomethyl)phenyl]-1,2,4-triazole
InChI Key	NOUAEJFAVOHNSY-UHFFFAOYSA-N
Molecular Formula	C9H8BrN3

Benzyl alcohol, 99%

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Specifications

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-Methoxybenzyl alcohol, 98%

CAS: 105-13-5 Molecular Formula: C8H10O2 Molecular Weight (g/mol): 138.17 MDL Number: MFCD00004653 InChI Key: MSHFRERJPWKJFX-UHFFFAOYSA-N Synonym: 4-methoxybenzyl alcohol,4-methoxyphenyl methanol,anise alcohol,anisyl alcohol,p-anisyl alcohol,p-methoxybenzyl alcohol,benzenemethanol, 4-methoxy,anisic alcohol,p-anisol alcohol,4-methoxybenzenemethanol PubChem CID: 7738 ChEBI: CHEBI:86918 IUPAC Name: (4-methoxyphenyl)methanol SMILES: COC1=CC=C(CO)C=C1

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Specifications

PubChem CID	7738
CAS	105-13-5
Molecular Weight (g/mol)	138.17
ChEBI	CHEBI:86918
MDL Number	MFCD00004653
SMILES	COC1=CC=C(CO)C=C1
Synonym	4-methoxybenzyl alcohol,4-methoxyphenyl methanol,anise alcohol,anisyl alcohol,p-anisyl alcohol,p-methoxybenzyl alcohol,benzenemethanol, 4-methoxy,anisic alcohol,p-anisol alcohol,4-methoxybenzenemethanol
IUPAC Name	(4-methoxyphenyl)methanol
InChI Key	MSHFRERJPWKJFX-UHFFFAOYSA-N
Molecular Formula	C8H10O2

3-Nitrobenzyl chloride, 98%

CAS: 619-23-8 Molecular Formula: C7H6ClNO2 Molecular Weight (g/mol): 171.58 MDL Number: MFCD00007272 InChI Key: APGGSERFJKEWFG-UHFFFAOYSA-N Synonym: 3-nitrobenzyl chloride,1-chloromethyl-3-nitrobenzene,m-nitrobenzyl chloride,alpha-chloro-3-nitrotoluene,benzene, 1-chloromethyl-3-nitro,toluene, alpha-chloro-m-nitro,.alpha.-chloro-m-nitrotoluene,unii-ojl133898o,3-nitrobenzylchloride,ccris 2324 PubChem CID: 12078 IUPAC Name: 1-(chloromethyl)-3-nitrobenzene SMILES: [O-][N+](=O)C1=CC=CC(CCl)=C1

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PubChem CID	12078
CAS	619-23-8
Molecular Weight (g/mol)	171.58
MDL Number	MFCD00007272
SMILES	[O-][N+](=O)C1=CC=CC(CCl)=C1
Synonym	3-nitrobenzyl chloride,1-chloromethyl-3-nitrobenzene,m-nitrobenzyl chloride,alpha-chloro-3-nitrotoluene,benzene, 1-chloromethyl-3-nitro,toluene, alpha-chloro-m-nitro,.alpha.-chloro-m-nitrotoluene,unii-ojl133898o,3-nitrobenzylchloride,ccris 2324
IUPAC Name	1-(chloromethyl)-3-nitrobenzene
InChI Key	APGGSERFJKEWFG-UHFFFAOYSA-N
Molecular Formula	C7H6ClNO2

2-Chlorobenzyl chloride, 98+%

CAS: 611-19-8 Molecular Formula: C₇H₆Cl₂ Molecular Weight (g/mol): 161.03 MDL Number: MFCD00000893 InChI Key: BASMANVIUSSIIM-UHFFFAOYSA-N Synonym: 2-chlorobenzyl chloride,1-chloro-2-chloromethyl benzene,2-chlorobenzylchloride,o-chlorobenzyl chloride,alpha,2-dichlorotoluene,benzene, 1-chloro-2-chloromethyl,alpha,o-dichlorotoluene,ar,alpha-dichlorotoluene,ortho-alpha-dichlorotoluene,unii-h58di83rmd PubChem CID: 11906 IUPAC Name: 1-chloro-2-(chloromethyl)benzene SMILES: C1=CC=C(C(=C1)CCl)Cl

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PubChem CID	11906
CAS	611-19-8
Molecular Weight (g/mol)	161.03
MDL Number	MFCD00000893
SMILES	C1=CC=C(C(=C1)CCl)Cl
Synonym	2-chlorobenzyl chloride,1-chloro-2-chloromethyl benzene,2-chlorobenzylchloride,o-chlorobenzyl chloride,alpha,2-dichlorotoluene,benzene, 1-chloro-2-chloromethyl,alpha,o-dichlorotoluene,ar,alpha-dichlorotoluene,ortho-alpha-dichlorotoluene,unii-h58di83rmd
IUPAC Name	1-chloro-2-(chloromethyl)benzene
InChI Key	BASMANVIUSSIIM-UHFFFAOYSA-N
Molecular Formula	C₇H₆Cl₂

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

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Specifications

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

1,2,4,5-Tetrakis(bromomethyl)benzene, 95%

CAS: 15442-91-8 Molecular Formula: C₁₀H₁₀Br₄ Molecular Weight (g/mol): 449.79 MDL Number: MFCD00009664 InChI Key: UTXIKCCNBUIWPT-UHFFFAOYSA-N Synonym: 1,2,4,5-tetrakis bromomethyl benzene,1,2,4,5-tetra bromomethyl benzene,1,2,4,5-tetrakis-bromomethyl-benzene,benzene, 1,2,4,5-tetrakis bromomethyl,1,2,4,5-tetrakis bromomethyl-benzene,ksc182m6b,alpha,alpha',alpha,alpha'-tetrabromodurene,1,2,4,5-tetrakis bromomethyl benzene 5g PubChem CID: 284971 IUPAC Name: 1,2,4,5-tetrakis(bromomethyl)benzene SMILES: C1=C(C(=CC(=C1CBr)CBr)CBr)CBr

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Specifications

PubChem CID	284971
CAS	15442-91-8
Molecular Weight (g/mol)	449.79
MDL Number	MFCD00009664
SMILES	C1=C(C(=CC(=C1CBr)CBr)CBr)CBr
Synonym	1,2,4,5-tetrakis bromomethyl benzene,1,2,4,5-tetra bromomethyl benzene,1,2,4,5-tetrakis-bromomethyl-benzene,benzene, 1,2,4,5-tetrakis bromomethyl,1,2,4,5-tetrakis bromomethyl-benzene,ksc182m6b,alpha,alpha',alpha,alpha'-tetrabromodurene,1,2,4,5-tetrakis bromomethyl benzene 5g
IUPAC Name	1,2,4,5-tetrakis(bromomethyl)benzene
InChI Key	UTXIKCCNBUIWPT-UHFFFAOYSA-N
Molecular Formula	C₁₀H₁₀Br₄

Benzyl alcohol, for analysis

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Specifications

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-(Bromomethyl)phenylboronic acid, 97%

CAS: 68162-47-0 Molecular Formula: C7H8BBrO2 Molecular Weight (g/mol): 214.85 MDL Number: MFCD01318113 InChI Key: PDNOURKEZJZJNZ-UHFFFAOYSA-N Synonym: 4-bromomethyl phenylboronic acid,4-bromomethylphenylboronic acid,4-bromomethyl phenyl boronic acid,4-bromomethyl benzeneboronic acid,4-boronobenzyl bromide,p-bromomethyl phenylboronic acid,4-bromomethylphenyl boronic acid,4-bromomethylbenzeneboronic acid,boronic acid, 4-bromomethyl phenyl PubChem CID: 2735593 IUPAC Name: [4-(bromomethyl)phenyl]boronic acid SMILES: OB(O)C1=CC=C(CBr)C=C1

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Specifications

PubChem CID	2735593
CAS	68162-47-0
Molecular Weight (g/mol)	214.85
MDL Number	MFCD01318113
SMILES	OB(O)C1=CC=C(CBr)C=C1
Synonym	4-bromomethyl phenylboronic acid,4-bromomethylphenylboronic acid,4-bromomethyl phenyl boronic acid,4-bromomethyl benzeneboronic acid,4-boronobenzyl bromide,p-bromomethyl phenylboronic acid,4-bromomethylphenyl boronic acid,4-bromomethylbenzeneboronic acid,boronic acid, 4-bromomethyl phenyl
IUPAC Name	[4-(bromomethyl)phenyl]boronic acid
InChI Key	PDNOURKEZJZJNZ-UHFFFAOYSA-N
Molecular Formula	C7H8BBrO2

Econazole, 99%, Thermo Scientific Chemicals

CAS: 27220-47-9 Molecular Formula: C18H15Cl3N2O Molecular Weight (g/mol): 381.68 MDL Number: MFCD00800993,MFCD00058160 (.HNO3) InChI Key: LEZWWPYKPKIXLL-UHFFFAOYNA-N Synonym: econazole,ecostatin,econazolum,pevaryl,gyno-pevaryl,econazol,palavale,spectazole,+--econazole,ecostatin cream PubChem CID: 3198 ChEBI: CHEBI:82873 IUPAC Name: 1-[2-[(4-chlorophenyl)methoxy]-2-(2,4-dichlorophenyl)ethyl]imidazole SMILES: ClC1=CC=C(COC(CN2C=CN=C2)C2=C(Cl)C=C(Cl)C=C2)C=C1

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Specifications

PubChem CID	3198
CAS	27220-47-9
Molecular Weight (g/mol)	381.68
ChEBI	CHEBI:82873
MDL Number	MFCD00800993,MFCD00058160 (.HNO3)
SMILES	ClC1=CC=C(COC(CN2C=CN=C2)C2=C(Cl)C=C(Cl)C=C2)C=C1
Synonym	econazole,ecostatin,econazolum,pevaryl,gyno-pevaryl,econazol,palavale,spectazole,+--econazole,ecostatin cream
IUPAC Name	1-[2-[(4-chlorophenyl)methoxy]-2-(2,4-dichlorophenyl)ethyl]imidazole
InChI Key	LEZWWPYKPKIXLL-UHFFFAOYNA-N
Molecular Formula	C18H15Cl3N2O

2-Fluoro-3-methylbenzyl bromide, 97%

CAS: 151412-12-3 Molecular Formula: C8H8BrF Molecular Weight (g/mol): 203.054 MDL Number: MFCD00042470 InChI Key: DCGWFNZSJBIAKE-UHFFFAOYSA-N Synonym: 2-fluoro-3-methylbenzyl bromide,1-bromomethyl-2-fluoro-3-methylbenzene,benzene,1-bromomethyl-2-fluoro-3-methyl,acmc-20anvi,2-fluoro-3-methylbenzylbromide,2-fluoro-3-methyl-benzylbromide,2-fluoro-3-methyl benzyl bromide,3-bromomethyl-2-fluoro-1-methylbenzene,1-bromomethyl-2-fluoro-3-methylbenzene # PubChem CID: 519062 IUPAC Name: 1-(bromomethyl)-2-fluoro-3-methylbenzene SMILES: CC1=C(C(=CC=C1)CBr)F

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Specifications

PubChem CID	519062
CAS	151412-12-3
Molecular Weight (g/mol)	203.054
MDL Number	MFCD00042470
SMILES	CC1=C(C(=CC=C1)CBr)F
Synonym	2-fluoro-3-methylbenzyl bromide,1-bromomethyl-2-fluoro-3-methylbenzene,benzene,1-bromomethyl-2-fluoro-3-methyl,acmc-20anvi,2-fluoro-3-methylbenzylbromide,2-fluoro-3-methyl-benzylbromide,2-fluoro-3-methyl benzyl bromide,3-bromomethyl-2-fluoro-1-methylbenzene,1-bromomethyl-2-fluoro-3-methylbenzene #
IUPAC Name	1-(bromomethyl)-2-fluoro-3-methylbenzene
InChI Key	DCGWFNZSJBIAKE-UHFFFAOYSA-N
Molecular Formula	C8H8BrF

4-(Chloromethyl)benzonitrile, 98+%

CAS: 874-86-2 Molecular Formula: C8H6ClN Molecular Weight (g/mol): 151.593 MDL Number: MFCD00019761 InChI Key: LOQLDQJTSMKBJU-UHFFFAOYSA-N Synonym: 4-chloromethyl benzonitrile,4-cyanobenzyl chloride,4-chloromethyl-benzonitrile,benzonitrile, 4-chloromethyl,ccris 5103,p-cyanobenzyl chloride,4-chloromethyl benzenecarbonitrile,4-cyanobenzylchloride,pubchem7377,alp.-chloro-p-tolunitrile PubChem CID: 70127 IUPAC Name: 4-(chloromethyl)benzonitrile SMILES: C1=CC(=CC=C1CCl)C#N

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Specifications

PubChem CID	70127
CAS	874-86-2
Molecular Weight (g/mol)	151.593
MDL Number	MFCD00019761
SMILES	C1=CC(=CC=C1CCl)C#N
Synonym	4-chloromethyl benzonitrile,4-cyanobenzyl chloride,4-chloromethyl-benzonitrile,benzonitrile, 4-chloromethyl,ccris 5103,p-cyanobenzyl chloride,4-chloromethyl benzenecarbonitrile,4-cyanobenzylchloride,pubchem7377,alp.-chloro-p-tolunitrile
IUPAC Name	4-(chloromethyl)benzonitrile
InChI Key	LOQLDQJTSMKBJU-UHFFFAOYSA-N
Molecular Formula	C8H6ClN

[3-(1H-1,2,4-Triazol-1-ylmethyl)phenyl]methanol, ≥97%, Thermo Scientific™

CAS: 871825-54-6 Molecular Formula: C10H11N3O Molecular Weight (g/mol): 189.22 MDL Number: MFCD08271929 InChI Key: PZRKSBSNVMSIJI-UHFFFAOYSA-N Synonym: 3-1h-1,2,4-triazol-1-ylmethyl phenyl methanol,3-1h-1,2,4-triazol-1-yl methyl phenyl methanol,3-1,2,4-triazol-1-ylmethyl phenyl methanol,3-1h-1,2,4-triazol-1-yl methyl benzyl alcohol,3-1,2,4-triazolylmethyl phenyl methan-1-ol PubChem CID: 18525775 SMILES: OCC1=CC=CC(CN2C=NC=N2)=C1

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Specifications

PubChem CID	18525775
CAS	871825-54-6
Molecular Weight (g/mol)	189.22
MDL Number	MFCD08271929
SMILES	OCC1=CC=CC(CN2C=NC=N2)=C1
Synonym	3-1h-1,2,4-triazol-1-ylmethyl phenyl methanol,3-1h-1,2,4-triazol-1-yl methyl phenyl methanol,3-1,2,4-triazol-1-ylmethyl phenyl methanol,3-1h-1,2,4-triazol-1-yl methyl benzyl alcohol,3-1,2,4-triazolylmethyl phenyl methan-1-ol
InChI Key	PZRKSBSNVMSIJI-UHFFFAOYSA-N
Molecular Formula	C10H11N3O

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