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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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-(Phenoxymethyl)phenyl]methanol, 97%, Thermo Scientific™

CAS: 34904-99-9 Molecular Formula: C14H14O2 Molecular Weight (g/mol): 214.264 MDL Number: MFCD09025916 InChI Key: ZKZSJQJXKWKOJY-UHFFFAOYSA-N Synonym: 3-phenoxymethyl phenyl methanol,3-phenoxymethyl phenyl methan-1-ol PubChem CID: 12399930 IUPAC Name: [3-(phenoxymethyl)phenyl]methanol SMILES: C1=CC=C(C=C1)OCC2=CC=CC(=C2)CO

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PubChem CID	12399930
CAS	34904-99-9
Molecular Weight (g/mol)	214.264
MDL Number	MFCD09025916
SMILES	C1=CC=C(C=C1)OCC2=CC=CC(=C2)CO
Synonym	3-phenoxymethyl phenyl methanol,3-phenoxymethyl phenyl methan-1-ol
IUPAC Name	[3-(phenoxymethyl)phenyl]methanol
InChI Key	ZKZSJQJXKWKOJY-UHFFFAOYSA-N
Molecular Formula	C14H14O2

4-[4-(Bromomethyl)phenyl]-1,2,3-thiadiazole, 97%, Thermo Scientific™

CAS: 163798-92-3 Molecular Formula: C9H7BrN2S Molecular Weight (g/mol): 255.13 MDL Number: MFCD00052102 InChI Key: DGHQOPZIGDRUIT-UHFFFAOYSA-N Synonym: 4-4-bromomethyl phenyl-1,2,3-thiadiazole,1,2,3-thiadiazole,4-4-bromomethyl phenyl,4-4-bromomethyl phenyl thiadiazole,4-1,2,3-thiadiazol-4-yl benzyl bromide,4-4-bromomethylphenyl-1,2,3-thiadiazole,4-4-bromomethyl-phenyl-1,2,3 thiadiazole PubChem CID: 2776454 IUPAC Name: 4-[4-(bromomethyl)phenyl]thiadiazole SMILES: BrCC1=CC=C(C=C1)C1=CSN=N1

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PubChem CID	2776454
CAS	163798-92-3
Molecular Weight (g/mol)	255.13
MDL Number	MFCD00052102
SMILES	BrCC1=CC=C(C=C1)C1=CSN=N1
Synonym	4-4-bromomethyl phenyl-1,2,3-thiadiazole,1,2,3-thiadiazole,4-4-bromomethyl phenyl,4-4-bromomethyl phenyl thiadiazole,4-1,2,3-thiadiazol-4-yl benzyl bromide,4-4-bromomethylphenyl-1,2,3-thiadiazole,4-4-bromomethyl-phenyl-1,2,3 thiadiazole
IUPAC Name	4-[4-(bromomethyl)phenyl]thiadiazole
InChI Key	DGHQOPZIGDRUIT-UHFFFAOYSA-N
Molecular Formula	C9H7BrN2S

2-[2-(Bromomethyl)phenyl]thiophene, ≥95%, Thermo Scientific™

CAS: 791078-04-1 Molecular Formula: C11H9BrS Molecular Weight (g/mol): 253.157 MDL Number: MFCD07368537 InChI Key: IJNVNLWIQXMBPA-UHFFFAOYSA-N PubChem CID: 7060555 IUPAC Name: 2-[2-(bromomethyl)phenyl]thiophene SMILES: C1=CC=C(C(=C1)CBr)C2=CC=CS2

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PubChem CID	7060555
CAS	791078-04-1
Molecular Weight (g/mol)	253.157
MDL Number	MFCD07368537
SMILES	C1=CC=C(C(=C1)CBr)C2=CC=CS2
IUPAC Name	2-[2-(bromomethyl)phenyl]thiophene
InChI Key	IJNVNLWIQXMBPA-UHFFFAOYSA-N
Molecular Formula	C11H9BrS

2-chlorobenzyl bromide, 97%

CAS: 611-17-6 Molecular Formula: C₇H₇BrCl Molecular Weight (g/mol): 205.49 MDL Number: MFCD00000566 InChI Key: PURSZYWBIQIANP-UHFFFAOYSA-N Synonym: 2-chlorobenzyl bromide,1-bromomethyl-2-chlorobenzene,o-chlorobenzyl bromide,2-chlorobenzylbromide,benzene, 1-bromomethyl-2-chloro,alpha-bromo-2-chlorotoluene,unii-cev23h8uv4,2chlorobenzyl bromide,alpha-bromo-o-chlorotoluene,cev23h8uv4 PubChem CID: 11905 IUPAC Name: 1-(bromomethyl)-2-chlorobenzene SMILES: C1=CC=C(C(=C1)CBr)Cl

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PubChem CID	11905
CAS	611-17-6
Molecular Weight (g/mol)	205.49
MDL Number	MFCD00000566
SMILES	C1=CC=C(C(=C1)CBr)Cl
Synonym	2-chlorobenzyl bromide,1-bromomethyl-2-chlorobenzene,o-chlorobenzyl bromide,2-chlorobenzylbromide,benzene, 1-bromomethyl-2-chloro,alpha-bromo-2-chlorotoluene,unii-cev23h8uv4,2chlorobenzyl bromide,alpha-bromo-o-chlorotoluene,cev23h8uv4
IUPAC Name	1-(bromomethyl)-2-chlorobenzene
InChI Key	PURSZYWBIQIANP-UHFFFAOYSA-N
Molecular Formula	C₇H₇BrCl

3-Methoxybenzyl alcohol, 98%

CAS: 6971-51-3 Molecular Formula: C₈H₁₀O₂ Molecular Weight (g/mol): 138.17 MDL Number: MFCD00004637 InChI Key: IIGNZLVHOZEOPV-UHFFFAOYSA-N Synonym: 3-methoxybenzyl alcohol,3-methoxyphenyl methanol,m-methoxybenzyl alcohol,3-methoxybenzylalcohol,m-anisyl alcohol,3-anise alcohol,3-anisyl alcohol,benzenemethanol, 3-methoxy,unii-i1xc3698n5,3-methoxyphenyl methan-1-ol PubChem CID: 81437 ChEBI: CHEBI:1580 IUPAC Name: (3-methoxyphenyl)methanol SMILES: COC1=CC=CC(=C1)CO

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PubChem CID	81437
CAS	6971-51-3
Molecular Weight (g/mol)	138.17
ChEBI	CHEBI:1580
MDL Number	MFCD00004637
SMILES	COC1=CC=CC(=C1)CO
Synonym	3-methoxybenzyl alcohol,3-methoxyphenyl methanol,m-methoxybenzyl alcohol,3-methoxybenzylalcohol,m-anisyl alcohol,3-anise alcohol,3-anisyl alcohol,benzenemethanol, 3-methoxy,unii-i1xc3698n5,3-methoxyphenyl methan-1-ol
IUPAC Name	(3-methoxyphenyl)methanol
InChI Key	IIGNZLVHOZEOPV-UHFFFAOYSA-N
Molecular Formula	C₈H₁₀O₂

Trimethyl orthobenzoate, 97%

CAS: 707-07-3 Molecular Formula: C₁₀H₁₄O₃ Molecular Weight (g/mol): 182.22 MDL Number: MFCD00008474 InChI Key: IECKAVQTURBPON-UHFFFAOYSA-N Synonym: trimethyl orthobenzoate,trimethoxymethyl benzene,methyl orthobenzoate,benzene, trimethoxymethyl,trimethylorthobenzoate,orthobenzoic acid, trimethyl ester,orthobenzoic acid trimethyl ester,alpha,alpha,alpha-trimethoxytoluene,trimethoxyphenylmethane,trimethyl orthobeznoate PubChem CID: 69720 IUPAC Name: trimethoxymethylbenzene SMILES: COC(C1=CC=CC=C1)(OC)OC

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PubChem CID	69720
CAS	707-07-3
Molecular Weight (g/mol)	182.22
MDL Number	MFCD00008474
SMILES	COC(C1=CC=CC=C1)(OC)OC
Synonym	trimethyl orthobenzoate,trimethoxymethyl benzene,methyl orthobenzoate,benzene, trimethoxymethyl,trimethylorthobenzoate,orthobenzoic acid, trimethyl ester,orthobenzoic acid trimethyl ester,alpha,alpha,alpha-trimethoxytoluene,trimethoxyphenylmethane,trimethyl orthobeznoate
IUPAC Name	trimethoxymethylbenzene
InChI Key	IECKAVQTURBPON-UHFFFAOYSA-N
Molecular Formula	C₁₀H₁₄O₃

2-Hydroxybenzyl alcohol, 97%

CAS: 90-01-7 Molecular Formula: C7H8O2 Molecular Weight (g/mol): 124.14 MDL Number: MFCD00004617 InChI Key: CQRYARSYNCAZFO-UHFFFAOYSA-N Synonym: salicyl alcohol,2-hydroxybenzyl alcohol,saligenin,2-hydroxymethyl phenol,2-methylolphenol,o-hydroxybenzyl alcohol,saligenol,benzenemethanol, 2-hydroxy,diathesin,o-methylolphenol PubChem CID: 5146 ChEBI: CHEBI:16464 IUPAC Name: 2-(hydroxymethyl)phenol SMILES: OCC1=CC=CC=C1O

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Specifications

PubChem CID	5146
CAS	90-01-7
Molecular Weight (g/mol)	124.14
ChEBI	CHEBI:16464
MDL Number	MFCD00004617
SMILES	OCC1=CC=CC=C1O
Synonym	salicyl alcohol,2-hydroxybenzyl alcohol,saligenin,2-hydroxymethyl phenol,2-methylolphenol,o-hydroxybenzyl alcohol,saligenol,benzenemethanol, 2-hydroxy,diathesin,o-methylolphenol
IUPAC Name	2-(hydroxymethyl)phenol
InChI Key	CQRYARSYNCAZFO-UHFFFAOYSA-N
Molecular Formula	C7H8O2

4-Iodobenzyl bromide, 97%

CAS: 16004-15-2 Molecular Formula: C₇H₆BrI Molecular Weight (g/mol): 296.93 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

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PubChem CID	954258
CAS	16004-15-2
Molecular Weight (g/mol)	296.93
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

(R)-(-)-alpha-Methoxy-alpha-(trifluoromethyl)phenylacetyl chloride, 98+%

CAS: 39637-99-5 Molecular Formula: C10H8ClF3O2 Molecular Weight (g/mol): 252.62 MDL Number: MFCD00044400 InChI Key: PAORVUMOXXAMPL-VIFPVBQESA-N Synonym: unii-81ut10uhv3,r---mtpa-cl,--alpha-methoxy-alpha-trifluoromethyl phenylacetyl chloride,r---alpha-methoxy-alpha-trifluoromethyl phenylacetyl chloride,r-3,3,3-trifluoro-2-methoxy-2-phenylpropanoyl chloride,2r-3,3,3-trifluoro-2-methoxy-2-phenylpropanoyl chloride,r---a-methoxy-a-trifluoromethylphenylacetyl chloride,r---alpha-methoxy-alpha-trifluoromethylphenylacetyl chloride,--mtpa-cl,--mosher's acid chloride PubChem CID: 3080792 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

PubChem CID	3080792
CAS	39637-99-5
Molecular Weight (g/mol)	252.62
MDL Number	MFCD00044400
SMILES	CO[C@](C(Cl)=O)(C1=CC=CC=C1)C(F)(F)F
Synonym	unii-81ut10uhv3,r---mtpa-cl,--alpha-methoxy-alpha-trifluoromethyl phenylacetyl chloride,r---alpha-methoxy-alpha-trifluoromethyl phenylacetyl chloride,r-3,3,3-trifluoro-2-methoxy-2-phenylpropanoyl chloride,2r-3,3,3-trifluoro-2-methoxy-2-phenylpropanoyl chloride,r---a-methoxy-a-trifluoromethylphenylacetyl chloride,r---alpha-methoxy-alpha-trifluoromethylphenylacetyl chloride,--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-Aminobenzyl alcohol, 97%

CAS: 1877-77-6 Molecular Formula: C7H9NO Molecular Weight (g/mol): 123.16 MDL Number: MFCD00007817 InChI Key: OJZQOQNSUZLSMV-UHFFFAOYSA-N Synonym: 3-aminobenzyl alcohol,3-aminophenyl methanol,m-aminobenzyl alcohol,3-aminobenzylalcohol,3-hydroxymethyl aniline,benzenemethanol, 3-amino,benzyl alcohol, m-amino,3-aminobenzenemethanol,unii-kn96abq0sp,m-aminophenylcarbinol PubChem CID: 80293 IUPAC Name: (3-aminophenyl)methanol SMILES: NC1=CC=CC(CO)=C1

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PubChem CID	80293
CAS	1877-77-6
Molecular Weight (g/mol)	123.16
MDL Number	MFCD00007817
SMILES	NC1=CC=CC(CO)=C1
Synonym	3-aminobenzyl alcohol,3-aminophenyl methanol,m-aminobenzyl alcohol,3-aminobenzylalcohol,3-hydroxymethyl aniline,benzenemethanol, 3-amino,benzyl alcohol, m-amino,3-aminobenzenemethanol,unii-kn96abq0sp,m-aminophenylcarbinol
IUPAC Name	(3-aminophenyl)methanol
InChI Key	OJZQOQNSUZLSMV-UHFFFAOYSA-N
Molecular Formula	C7H9NO

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

Doxylamine succinate, 98%

CAS: 562-10-7 Molecular Formula: C21H28N2O5 Molecular Weight (g/mol): 388.46 MDL Number: MFCD00056168 InChI Key: KBAUFVUYFNWQFM-UHFFFAOYNA-N Synonym: doxylamine succinate,decapryn,evigoa d,a-h injection,decapryn succinate,unisom,alsadorm,gittalun,mereprine PubChem CID: 11224 ChEBI: CHEBI:82461 IUPAC Name: butanedioic acid;N,N-dimethyl-2-(1-phenyl-1-pyridin-2-ylethoxy)ethanamine SMILES: OC(=O)CCC(O)=O.CN(C)CCOC(C)(C1=CC=CC=C1)C1=CC=CC=N1

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Specifications

PubChem CID	11224
CAS	562-10-7
Molecular Weight (g/mol)	388.46
ChEBI	CHEBI:82461
MDL Number	MFCD00056168
SMILES	OC(=O)CCC(O)=O.CN(C)CCOC(C)(C1=CC=CC=C1)C1=CC=CC=N1
Synonym	doxylamine succinate,decapryn,evigoa d,a-h injection,decapryn succinate,unisom,alsadorm,gittalun,mereprine
IUPAC Name	butanedioic acid;N,N-dimethyl-2-(1-phenyl-1-pyridin-2-ylethoxy)ethanamine
InChI Key	KBAUFVUYFNWQFM-UHFFFAOYNA-N
Molecular Formula	C21H28N2O5

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