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 (NF), 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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Benzyl Alcohol (Certified ACS), Fisher Chemical™

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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

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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Specifications

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

3-Bromo-2-fluorobenzyl bromide, 97%, Thermo Scientific Chemicals

CAS: 149947-16-0 Molecular Formula: C7H5Br2F Molecular Weight (g/mol): 267.923 MDL Number: MFCD09842442 InChI Key: MGVHFTWDCYIBDO-UHFFFAOYSA-N PubChem CID: 18989440 IUPAC Name: 1-bromo-3-(bromomethyl)-2-fluorobenzene SMILES: C1=CC(=C(C(=C1)Br)F)CBr

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Specifications

PubChem CID	18989440
CAS	149947-16-0
Molecular Weight (g/mol)	267.923
MDL Number	MFCD09842442
SMILES	C1=CC(=C(C(=C1)Br)F)CBr
IUPAC Name	1-bromo-3-(bromomethyl)-2-fluorobenzene
InChI Key	MGVHFTWDCYIBDO-UHFFFAOYSA-N
Molecular Formula	C7H5Br2F

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

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Specifications

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-Bromophenylacetonitrile, 99%

CAS: 16532-79-9 Molecular Formula: C8H6BrN Molecular Weight (g/mol): 196.05 MDL Number: MFCD00001916 InChI Key: MFHFWRBXPQDZSA-UHFFFAOYSA-N Synonym: 4-bromophenylacetonitrile,4-bromobenzyl cyanide,2-4-bromophenyl acetonitrile,benzeneacetonitrile, 4-bromo,p-bromophenylacetonitrile,4-bromobenzylcyanide,4-bromobenzeneacetonitrile,p-bromobenzyl cyanide,p-bromobenzylcyanide,acetonitrile, p-bromophenyl PubChem CID: 27914 IUPAC Name: 2-(4-bromophenyl)acetonitrile SMILES: BrC1=CC=C(CC#N)C=C1

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Specifications

PubChem CID	27914
CAS	16532-79-9
Molecular Weight (g/mol)	196.05
MDL Number	MFCD00001916
SMILES	BrC1=CC=C(CC#N)C=C1
Synonym	4-bromophenylacetonitrile,4-bromobenzyl cyanide,2-4-bromophenyl acetonitrile,benzeneacetonitrile, 4-bromo,p-bromophenylacetonitrile,4-bromobenzylcyanide,4-bromobenzeneacetonitrile,p-bromobenzyl cyanide,p-bromobenzylcyanide,acetonitrile, p-bromophenyl
IUPAC Name	2-(4-bromophenyl)acetonitrile
InChI Key	MFHFWRBXPQDZSA-UHFFFAOYSA-N
Molecular Formula	C8H6BrN

4-Chlorobenzyl alcohol, 99%

CAS: 873-76-7 Molecular Formula: C₇H₇ClO Molecular Weight (g/mol): 142.58 MDL Number: MFCD00004652 InChI Key: PTHGDVCPCZKZKR-UHFFFAOYSA-N Synonym: 4-chlorobenzyl alcohol,4-chlorophenyl methanol,p-chlorobenzyl alcohol,benzenemethanol, 4-chloro,4-chlorobenzenemethanol,4-chlorobenzylalcohol,benzyl alcohol, p-chloro,4-chlorobenzylic alcohol,unii-gf8bs53b6v,ccris 5120 PubChem CID: 13397 IUPAC Name: (4-chlorophenyl)methanol SMILES: C1=CC(=CC=C1CO)Cl

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Specifications

PubChem CID	13397
CAS	873-76-7
Molecular Weight (g/mol)	142.58
MDL Number	MFCD00004652
SMILES	C1=CC(=CC=C1CO)Cl
Synonym	4-chlorobenzyl alcohol,4-chlorophenyl methanol,p-chlorobenzyl alcohol,benzenemethanol, 4-chloro,4-chlorobenzenemethanol,4-chlorobenzylalcohol,benzyl alcohol, p-chloro,4-chlorobenzylic alcohol,unii-gf8bs53b6v,ccris 5120
IUPAC Name	(4-chlorophenyl)methanol
InChI Key	PTHGDVCPCZKZKR-UHFFFAOYSA-N
Molecular Formula	C₇H₇ClO

alpha,alpha'-Dichloro-o-xylene, 98%

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2-Iodobenzyl alcohol, 99%

CAS: 5159-41-1 Molecular Formula: C₇H₇IO Molecular Weight (g/mol): 234.04 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

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Specifications

PubChem CID	107629
CAS	5159-41-1
Molecular Weight (g/mol)	234.04
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

2-Methylbenzyl bromide, 98%

CAS: 89-92-9 Molecular Formula: C8H9Br Molecular Weight (g/mol): 185.064 MDL Number: MFCD00000174 InChI Key: WGVYCXYGPNNUQA-UHFFFAOYSA-N Synonym: 2-methylbenzyl bromide,1-bromomethyl-2-methylbenzene,alpha-bromo-o-xylene,o-xylyl bromide,o-methylbenzyl bromide,2-xylyl bromide,2-bromomethyl toluene,2-methylbenzylbromide,benzene, 1-bromomethyl-2-methyl,a-bromo-o-xylene PubChem CID: 6992 IUPAC Name: 1-(bromomethyl)-2-methylbenzene SMILES: CC1=CC=CC=C1CBr

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Specifications

PubChem CID	6992
CAS	89-92-9
Molecular Weight (g/mol)	185.064
MDL Number	MFCD00000174
SMILES	CC1=CC=CC=C1CBr
Synonym	2-methylbenzyl bromide,1-bromomethyl-2-methylbenzene,alpha-bromo-o-xylene,o-xylyl bromide,o-methylbenzyl bromide,2-xylyl bromide,2-bromomethyl toluene,2-methylbenzylbromide,benzene, 1-bromomethyl-2-methyl,a-bromo-o-xylene
IUPAC Name	1-(bromomethyl)-2-methylbenzene
InChI Key	WGVYCXYGPNNUQA-UHFFFAOYSA-N
Molecular Formula	C8H9Br

1,2-Phenylenediacetonitrile, 98%

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

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Specifications

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-Benzyloxypyrrolidine, 96%

CAS: 420137-14-0 Molecular Formula: C11H15NO Molecular Weight (g/mol): 177.247 MDL Number: MFCD08060975 InChI Key: CWBMYKUPMLRKQK-UHFFFAOYSA-N Synonym: 3-benzyloxy pyrrolidine,3-benzyloxypyrrolidine,3-benzyloxy-pyrrolidine,3-phenylmethoxy pyrrolidine,benzyl pyrrolidin-3-yl ether,pyrrolidin-3-yl oxy methyl benzene PubChem CID: 14497353 IUPAC Name: 3-phenylmethoxypyrrolidine SMILES: C1CNCC1OCC2=CC=CC=C2

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Specifications

PubChem CID	14497353
CAS	420137-14-0
Molecular Weight (g/mol)	177.247
MDL Number	MFCD08060975
SMILES	C1CNCC1OCC2=CC=CC=C2
Synonym	3-benzyloxy pyrrolidine,3-benzyloxypyrrolidine,3-benzyloxy-pyrrolidine,3-phenylmethoxy pyrrolidine,benzyl pyrrolidin-3-yl ether,pyrrolidin-3-yl oxy methyl benzene
IUPAC Name	3-phenylmethoxypyrrolidine
InChI Key	CWBMYKUPMLRKQK-UHFFFAOYSA-N
Molecular Formula	C11H15NO

4-Fluoro-3-(hydroxymethyl)benzeneboronic acid, 98%

CAS: 481681-02-1 Molecular Formula: C7H8BFO3 Molecular Weight (g/mol): 169.95 MDL Number: MFCD08235075 InChI Key: PWMOQHMTXJYUGE-UHFFFAOYSA-N Synonym: 4-fluoro-3-hydroxymethyl phenyl boronic acid,4-fluoro-3-hydroxymethyl phenylboronic acid,4-fluoro-3-hydroxymethyl benzeneboronic acid,4-fluoro-3-hydroxymethylphenylboronic acid,boronic acid, 4-fluoro-3-hydroxymethyl phenyl,boronic acid,b-4-fluoro-3-hydroxymethyl phenyl,pubchem23767,acmc-209kcj,ksc496e1t PubChem CID: 21865588 IUPAC Name: [4-fluoro-3-(hydroxymethyl)phenyl]boronic acid SMILES: OCC1=C(F)C=CC(=C1)B(O)O

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Specifications

PubChem CID	21865588
CAS	481681-02-1
Molecular Weight (g/mol)	169.95
MDL Number	MFCD08235075
SMILES	OCC1=C(F)C=CC(=C1)B(O)O
Synonym	4-fluoro-3-hydroxymethyl phenyl boronic acid,4-fluoro-3-hydroxymethyl phenylboronic acid,4-fluoro-3-hydroxymethyl benzeneboronic acid,4-fluoro-3-hydroxymethylphenylboronic acid,boronic acid, 4-fluoro-3-hydroxymethyl phenyl,boronic acid,b-4-fluoro-3-hydroxymethyl phenyl,pubchem23767,acmc-209kcj,ksc496e1t
IUPAC Name	[4-fluoro-3-(hydroxymethyl)phenyl]boronic acid
InChI Key	PWMOQHMTXJYUGE-UHFFFAOYSA-N
Molecular Formula	C7H8BFO3

4-Biphenylmethanol, 98+%

CAS: 3597-91-9 Molecular Formula: C13H12O Molecular Weight (g/mol): 184.238 MDL Number: MFCD00004660 InChI Key: AXCHZLOJGKSWLV-UHFFFAOYSA-N Synonym: 4-biphenylmethanol,4-phenylphenyl methanol,biphenyl-4-ylmethanol,4-phenylbenzyl alcohol,p-phenylbenzyl alcohol,4-hydroxymethylbiphenyl,1,1'-biphenyl-4-ylmethanol,biphenyl-4-methanol,4-hydroxymethyl biphenyl,4hmb PubChem CID: 19186 IUPAC Name: (4-phenylphenyl)methanol SMILES: C1=CC=C(C=C1)C2=CC=C(C=C2)CO

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Specifications

PubChem CID	19186
CAS	3597-91-9
Molecular Weight (g/mol)	184.238
MDL Number	MFCD00004660
SMILES	C1=CC=C(C=C1)C2=CC=C(C=C2)CO
Synonym	4-biphenylmethanol,4-phenylphenyl methanol,biphenyl-4-ylmethanol,4-phenylbenzyl alcohol,p-phenylbenzyl alcohol,4-hydroxymethylbiphenyl,1,1'-biphenyl-4-ylmethanol,biphenyl-4-methanol,4-hydroxymethyl biphenyl,4hmb
IUPAC Name	(4-phenylphenyl)methanol
InChI Key	AXCHZLOJGKSWLV-UHFFFAOYSA-N
Molecular Formula	C13H12O

Benzyloxyacetaldehyde diethyl acetal, 98%

CAS: 42783-78-8 Molecular Formula: C13H20O3 Molecular Weight (g/mol): 224.3 MDL Number: MFCD00051786 InChI Key: VTYTZCJKJNWMGA-UHFFFAOYSA-N Synonym: 2,2-diethoxyethoxy methyl benzene,benzyloxyacetaldehyde diethyl acetal,benzene, 2,2-diethoxyethoxy methyl,acmc-20alp5,1,1-diethoxy-2-benzyloxy ethane,2,2-diethoxy-ethoxymethyl-benzene,2,2-diethoxy-1-phenylmethoxy ethane,2-benzyloxy acetaldehyde diethyl acetal PubChem CID: 4321487 IUPAC Name: 2,2-diethoxyethoxymethylbenzene SMILES: CCOC(COCC1=CC=CC=C1)OCC

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Specifications

PubChem CID	4321487
CAS	42783-78-8
Molecular Weight (g/mol)	224.3
MDL Number	MFCD00051786
SMILES	CCOC(COCC1=CC=CC=C1)OCC
Synonym	2,2-diethoxyethoxy methyl benzene,benzyloxyacetaldehyde diethyl acetal,benzene, 2,2-diethoxyethoxy methyl,acmc-20alp5,1,1-diethoxy-2-benzyloxy ethane,2,2-diethoxy-ethoxymethyl-benzene,2,2-diethoxy-1-phenylmethoxy ethane,2-benzyloxy acetaldehyde diethyl acetal
IUPAC Name	2,2-diethoxyethoxymethylbenzene
InChI Key	VTYTZCJKJNWMGA-UHFFFAOYSA-N
Molecular Formula	C13H20O3

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