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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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

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-Chlorobenzyl chloride, 98+%

CAS: 104-83-6 Molecular Formula: C7H6Cl2 Molecular Weight (g/mol): 161.025 MDL Number: MFCD00000914 InChI Key: JQZAEUFPPSRDOP-UHFFFAOYSA-N Synonym: 4-chlorobenzyl chloride,1-chloro-4-chloromethyl benzene,p-chlorobenzyl chloride,benzene, 1-chloro-4-chloromethyl,alpha,4-dichlorotoluene,4-chlorobenzylchloride,4-chlorophenyl methyl chloride,1-chloro-4-chloromethyl-benzene,alpha,p-dichlorotoluene,toluene, p,alpha-dichloro PubChem CID: 7723 IUPAC Name: 1-chloro-4-(chloromethyl)benzene SMILES: C1=CC(=CC=C1CCl)Cl

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Specifications

PubChem CID	7723
CAS	104-83-6
Molecular Weight (g/mol)	161.025
MDL Number	MFCD00000914
SMILES	C1=CC(=CC=C1CCl)Cl
Synonym	4-chlorobenzyl chloride,1-chloro-4-chloromethyl benzene,p-chlorobenzyl chloride,benzene, 1-chloro-4-chloromethyl,alpha,4-dichlorotoluene,4-chlorobenzylchloride,4-chlorophenyl methyl chloride,1-chloro-4-chloromethyl-benzene,alpha,p-dichlorotoluene,toluene, p,alpha-dichloro
IUPAC Name	1-chloro-4-(chloromethyl)benzene
InChI Key	JQZAEUFPPSRDOP-UHFFFAOYSA-N
Molecular Formula	C7H6Cl2

LiChropur™ (S)-(+)-α-Methoxy-α-(trifluoromethyl)phenylacetyl chloride, 99.0%, MilliporeSigma™ Supelco™

CAS: 20445-33-4 Molecular Formula: C10H8ClF3O2 Molecular Weight (g/mol): 252.62 MDL Number: MFCD00067105 InChI Key: PAORVUMOXXAMPL-SECBINFHSA-N Synonym: (S)-(+)-MTPA-Cl; Mosher's acid chloride IUPAC Name: (2S)-3,3,3-trifluoro-2-methoxy-2-phenylpropanoyl chloride SMILES: CO[C@@](C(Cl)=O)(C1=CC=CC=C1)C(F)(F)F

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Specifications

CAS	20445-33-4
Molecular Weight (g/mol)	252.62
MDL Number	MFCD00067105
SMILES	CO[C@@](C(Cl)=O)(C1=CC=CC=C1)C(F)(F)F
Synonym	(S)-(+)-MTPA-Cl; Mosher's acid chloride
IUPAC Name	(2S)-3,3,3-trifluoro-2-methoxy-2-phenylpropanoyl chloride
InChI Key	PAORVUMOXXAMPL-SECBINFHSA-N
Molecular Formula	C10H8ClF3O2

LiChropur™ ™-(-)-α-Methoxy-α-(trifluoromethyl)phenylacetyl chloride, 99.0%, MilliporeSigma™ Supelco™

Molecular Formula: C10H8ClF3O2 Molecular Weight (g/mol): 252.62 MDL Number: MFCD00044400 InChI Key: PAORVUMOXXAMPL-VIFPVBQESA-N Synonym: (R)-(-)-MTPA-Cl; Mosher's acid chloride IUPAC Name: (2R)-3,3,3-trifluoro-2-methoxy-2-phenylpropanoyl chloride SMILES: CO[C@](C(Cl)=O)(C1=CC=CC=C1)C(F)(F)F

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Specifications

Molecular Weight (g/mol)	252.62
MDL Number	MFCD00044400
SMILES	CO[C@](C(Cl)=O)(C1=CC=CC=C1)C(F)(F)F
Synonym	(R)-(-)-MTPA-Cl; Mosher's acid chloride
IUPAC Name	(2R)-3,3,3-trifluoro-2-methoxy-2-phenylpropanoyl chloride
InChI Key	PAORVUMOXXAMPL-VIFPVBQESA-N
Molecular Formula	C10H8ClF3O2

3-Bromo-4-fluorobenzyl alcohol, 97%

CAS: 77771-03-0 Molecular Formula: C7H6BrFO Molecular Weight (g/mol): 205.026 MDL Number: MFCD00143093 InChI Key: HNVVROFWONXXGO-UHFFFAOYSA-N Synonym: 3-bromo-4-fluorobenzyl alcohol,3-bromo-4-fluorophenyl methanol,3-bromo-4-fluorobenzylalcohol,3-bromo-4-fluoro-phenyl-methanol,3-bromo-4-fluorophenyl methan-1-ol,pubchem4884,4-fluoro-3-bromobenzyl alcohol,3-bromo-4-fluoro-benzyl alcohol,4-fluoro-3-bromo-benzyl alcohol,3-bromo-4-fluoro benzyl alcohol PubChem CID: 2773351 IUPAC Name: (3-bromo-4-fluorophenyl)methanol SMILES: C1=CC(=C(C=C1CO)Br)F

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Specifications

PubChem CID	2773351
CAS	77771-03-0
Molecular Weight (g/mol)	205.026
MDL Number	MFCD00143093
SMILES	C1=CC(=C(C=C1CO)Br)F
Synonym	3-bromo-4-fluorobenzyl alcohol,3-bromo-4-fluorophenyl methanol,3-bromo-4-fluorobenzylalcohol,3-bromo-4-fluoro-phenyl-methanol,3-bromo-4-fluorophenyl methan-1-ol,pubchem4884,4-fluoro-3-bromobenzyl alcohol,3-bromo-4-fluoro-benzyl alcohol,4-fluoro-3-bromo-benzyl alcohol,3-bromo-4-fluoro benzyl alcohol
IUPAC Name	(3-bromo-4-fluorophenyl)methanol
InChI Key	HNVVROFWONXXGO-UHFFFAOYSA-N
Molecular Formula	C7H6BrFO

p-Anisaldehyde dimethyl acetal, 98%

CAS: 2186-92-7 Molecular Formula: C10H14O3 Molecular Weight (g/mol): 182.22 MDL Number: MFCD00036507 InChI Key: NNHYAHOTXLASEA-UHFFFAOYSA-N Synonym: 1-dimethoxymethyl-4-methoxybenzene,p-anisaldehyde dimethyl acetal,anisaldehyde dimethyl acetal,4-methoxybenzaldehyde dimethyl acetal,p-dimethoxymethyl anisole,benzene, 1-dimethoxymethyl-4-methoxy,p-anisaldehydedimethylacetal,unii-xte77a5et4,anisicaldehyde dimethylacetal,p-anisaldehyde dimethylacetal PubChem CID: 75140 IUPAC Name: 1-(dimethoxymethyl)-4-methoxybenzene SMILES: COC(OC)C1=CC=C(OC)C=C1

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Specifications

PubChem CID	75140
CAS	2186-92-7
Molecular Weight (g/mol)	182.22
MDL Number	MFCD00036507
SMILES	COC(OC)C1=CC=C(OC)C=C1
Synonym	1-dimethoxymethyl-4-methoxybenzene,p-anisaldehyde dimethyl acetal,anisaldehyde dimethyl acetal,4-methoxybenzaldehyde dimethyl acetal,p-dimethoxymethyl anisole,benzene, 1-dimethoxymethyl-4-methoxy,p-anisaldehydedimethylacetal,unii-xte77a5et4,anisicaldehyde dimethylacetal,p-anisaldehyde dimethylacetal
IUPAC Name	1-(dimethoxymethyl)-4-methoxybenzene
InChI Key	NNHYAHOTXLASEA-UHFFFAOYSA-N
Molecular Formula	C10H14O3

(+/-)-Miconazole nitrate, 98+%

CAS: 22832-87-7 Molecular Formula: C18H15Cl4N3O4 Molecular Weight (g/mol): 479.14 MDL Number: MFCD00058161 InChI Key: MCCACAIVAXEFAL-UHFFFAOYNA-N Synonym: miconazole nitrate,albistat,andergin,aflorix,conofite,florid,micatin,gyno-monistat,epi-monistat,gyno-daktar PubChem CID: 68553 IUPAC Name: 1-[2-(2,4-dichlorophenyl)-2-[(2,4-dichlorophenyl)methoxy]ethyl]-1H-imidazole; nitric acid SMILES: O[N+]([O-])=O.ClC1=CC=C(COC(CN2C=CN=C2)C2=CC=C(Cl)C=C2Cl)C(Cl)=C1

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Specifications

PubChem CID	68553
CAS	22832-87-7
Molecular Weight (g/mol)	479.14
MDL Number	MFCD00058161
SMILES	O[N+]([O-])=O.ClC1=CC=C(COC(CN2C=CN=C2)C2=CC=C(Cl)C=C2Cl)C(Cl)=C1
Synonym	miconazole nitrate,albistat,andergin,aflorix,conofite,florid,micatin,gyno-monistat,epi-monistat,gyno-daktar
IUPAC Name	1-[2-(2,4-dichlorophenyl)-2-[(2,4-dichlorophenyl)methoxy]ethyl]-1H-imidazole; nitric acid
InChI Key	MCCACAIVAXEFAL-UHFFFAOYNA-N
Molecular Formula	C18H15Cl4N3O4

Benzyl alcohol, ACS reagent

Pricing and Availability
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

Benzyl alcohol, ACS reagent

Pricing and Availability
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

Econazole nitrate

CAS: 24169-02-6 Molecular Formula: C18H16Cl3N3O4 Molecular Weight (g/mol): 444.693 MDL Number: MFCD00058160 InChI Key: DDXORDQKGIZAME-UHFFFAOYSA-N Synonym: econazole nitrate,ifenec,epi-pevaryl,gyno-pevaryl,econazole nitrate salt,pevaryl,+--econazole nitrate,spectazole,econazolum nitrate,gyno-pevaryl 150 PubChem CID: 68589 IUPAC Name: 1-[2-[(4-chlorophenyl)methoxy]-2-(2,4-dichlorophenyl)ethyl]imidazole;nitric acid SMILES: C1=CC(=CC=C1COC(CN2C=CN=C2)C3=C(C=C(C=C3)Cl)Cl)Cl.[N+](=O)(O)[O-]

Pricing and Availability
Specifications

PubChem CID	68589
CAS	24169-02-6
Molecular Weight (g/mol)	444.693
MDL Number	MFCD00058160
SMILES	C1=CC(=CC=C1COC(CN2C=CN=C2)C3=C(C=C(C=C3)Cl)Cl)Cl.[N+](=O)(O)[O-]
Synonym	econazole nitrate,ifenec,epi-pevaryl,gyno-pevaryl,econazole nitrate salt,pevaryl,+--econazole nitrate,spectazole,econazolum nitrate,gyno-pevaryl 150
IUPAC Name	1-[2-[(4-chlorophenyl)methoxy]-2-(2,4-dichlorophenyl)ethyl]imidazole;nitric acid
InChI Key	DDXORDQKGIZAME-UHFFFAOYSA-N
Molecular Formula	C18H16Cl3N3O4

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

Pricing and Availability
Specifications

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

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

Pricing and Availability
Specifications

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

2-Benzyloxyethanol, 98%

CAS: 622-08-2 Molecular Formula: C9H12O2 Molecular Weight (g/mol): 152.19 MDL Number: MFCD00002868 InChI Key: CUZKCNWZBXLAJX-UHFFFAOYSA-N Synonym: 2-benzyloxy ethanol,2-benzyloxyethanol,ethanol, 2-phenylmethoxy,ethylene glycol monobenzyl ether,2-benzyloxy-1-ethanol,benzyl cellosolve,glycol benzyl ether,ethanol, 2-benzyloxy,glycol monobenzyl ether PubChem CID: 12141 IUPAC Name: 2-phenylmethoxyethanol SMILES: OCCOCC1=CC=CC=C1

Pricing and Availability
Specifications

PubChem CID	12141
CAS	622-08-2
Molecular Weight (g/mol)	152.19
MDL Number	MFCD00002868
SMILES	OCCOCC1=CC=CC=C1
Synonym	2-benzyloxy ethanol,2-benzyloxyethanol,ethanol, 2-phenylmethoxy,ethylene glycol monobenzyl ether,2-benzyloxy-1-ethanol,benzyl cellosolve,glycol benzyl ether,ethanol, 2-benzyloxy,glycol monobenzyl ether
IUPAC Name	2-phenylmethoxyethanol
InChI Key	CUZKCNWZBXLAJX-UHFFFAOYSA-N
Molecular Formula	C9H12O2

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