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

CAS: 58419-69-5 Formule moléculaire: C9H8BrN3 Poids moléculaire (g/mol): 238.088 Numéro MDL: MFCD04113600 Clé InChI: NOUAEJFAVOHNSY-UHFFFAOYSA-N Synonyme: 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 CID PubChem: 2776489 Nom IUPAC: 1-[4-(bromomethyl)phenyl]-1,2,4-triazole SMILES: C1=CC(=CC=C1CBr)N2C=NC=N2

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Poids moléculaire (g/mol)	238.088
Synonyme	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
Numéro MDL	MFCD04113600
CAS	58419-69-5
CID PubChem	2776489
Nom IUPAC	1-[4-(bromomethyl)phenyl]-1,2,4-triazole
Clé InChI	NOUAEJFAVOHNSY-UHFFFAOYSA-N
SMILES	C1=CC(=CC=C1CBr)N2C=NC=N2
Formule moléculaire	C9H8BrN3

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Benzyl Alcohol (Certified ACS), Fisher Chemical™

CAS: 100-51-6 Formule moléculaire: C7H8O Poids moléculaire (g/mol): 108.14 Numéro MDL: MFCD00004599,MFCD03792087 Clé InChI: WVDDGKGOMKODPV-UHFFFAOYSA-N Synonyme: benzyl alcohol,benzenemethanol,phenylcarbinol,benzoyl alcohol,hydroxytoluene,benzenecarbinol,phenylmethyl alcohol,alpha-toluenol,hydroxymethyl benzene,benzylalcohol CID PubChem: 244 ChEBI: CHEBI:17987 Nom IUPAC: phenylmethanol SMILES: OCC1=CC=CC=C1

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Poids moléculaire (g/mol)	108.14
Synonyme	benzyl alcohol,benzenemethanol,phenylcarbinol,benzoyl alcohol,hydroxytoluene,benzenecarbinol,phenylmethyl alcohol,alpha-toluenol,hydroxymethyl benzene,benzylalcohol
Numéro MDL	MFCD00004599,MFCD03792087
CAS	100-51-6
CID PubChem	244
ChEBI	CHEBI:17987
Nom IUPAC	phenylmethanol
Clé InChI	WVDDGKGOMKODPV-UHFFFAOYSA-N
SMILES	OCC1=CC=CC=C1
Formule moléculaire	C7H8O

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Poids moléculaire (g/mol)	108.14
Synonyme	benzyl alcohol,benzenemethanol,phenylcarbinol,benzoyl alcohol,hydroxytoluene,benzenecarbinol,phenylmethyl alcohol,alpha-toluenol,hydroxymethyl benzene,benzylalcohol
Numéro MDL	MFCD00004599,MFCD03792087
CAS	100-51-6
CID PubChem	244
ChEBI	CHEBI:17987
Nom IUPAC	phenylmethanol
Clé InChI	WVDDGKGOMKODPV-UHFFFAOYSA-N
SMILES	OCC1=CC=CC=C1
Formule moléculaire	C7H8O

p-Anisaldehyde dimethyl acetal, 98%

CAS: 2186-92-7 Formule moléculaire: C10H14O3 Poids moléculaire (g/mol): 182.22 Numéro MDL: MFCD00036507 Clé InChI: NNHYAHOTXLASEA-UHFFFAOYSA-N Synonyme: 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 CID PubChem: 75140 Nom IUPAC: 1-(dimethoxymethyl)-4-methoxybenzene SMILES: COC(OC)C1=CC=C(OC)C=C1

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Poids moléculaire (g/mol)	182.22
Synonyme	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
Numéro MDL	MFCD00036507
CAS	2186-92-7
CID PubChem	75140
Nom IUPAC	1-(dimethoxymethyl)-4-methoxybenzene
Clé InChI	NNHYAHOTXLASEA-UHFFFAOYSA-N
SMILES	COC(OC)C1=CC=C(OC)C=C1
Formule moléculaire	C10H14O3

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

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

3,5-Dichlorobenzyl alcohol, 98%

CAS: 60211-57-6 Formule moléculaire: C7H6Cl2O Poids moléculaire (g/mol): 177.024 Numéro MDL: MFCD00004634 Clé InChI: VSNNLLQKDRCKCB-UHFFFAOYSA-N CID PubChem: 43236 Nom IUPAC: (3,5-dichlorophenyl)methanol SMILES: C1=C(C=C(C=C1Cl)Cl)CO

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Poids moléculaire (g/mol)	177.024
Numéro MDL	MFCD00004634
CAS	60211-57-6
CID PubChem	43236
Nom IUPAC	(3,5-dichlorophenyl)methanol
Clé InChI	VSNNLLQKDRCKCB-UHFFFAOYSA-N
SMILES	C1=C(C=C(C=C1Cl)Cl)CO
Formule moléculaire	C7H6Cl2O

m-Xylylene dichloride, 97%

CAS: 626-16-4 Formule moléculaire: C8H8Cl2 Poids moléculaire (g/mol): 175.052 Numéro MDL: MFCD00000912 Clé InChI: GRJWOKACBGZOKT-UHFFFAOYSA-N Synonyme: 1,3-bis chloromethyl benzene,alpha,alpha'-dichloro-m-xylene,m-xylylene dichloride,benzene, 1,3-bis chloromethyl,m-bis chloromethyl benzene,m-xylylene chloride,m-dichloroxylene,benzene, 1,3-dichloromethyl,ccris 1774,m-xylene, .alpha.,.alpha.'-dichloro CID PubChem: 12275 Nom IUPAC: 1,3-bis(chloromethyl)benzene SMILES: C1=CC(=CC(=C1)CCl)CCl

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Poids moléculaire (g/mol)	175.052
Synonyme	1,3-bis chloromethyl benzene,alpha,alpha'-dichloro-m-xylene,m-xylylene dichloride,benzene, 1,3-bis chloromethyl,m-bis chloromethyl benzene,m-xylylene chloride,m-dichloroxylene,benzene, 1,3-dichloromethyl,ccris 1774,m-xylene, .alpha.,.alpha.'-dichloro
Numéro MDL	MFCD00000912
CAS	626-16-4
CID PubChem	12275
Nom IUPAC	1,3-bis(chloromethyl)benzene
Clé InChI	GRJWOKACBGZOKT-UHFFFAOYSA-N
SMILES	C1=CC(=CC(=C1)CCl)CCl
Formule moléculaire	C8H8Cl2

o-Tolylacetonitrile, 98+%

CAS: 22364-68-7 Formule moléculaire: C9H9N Poids moléculaire (g/mol): 131.178 Numéro MDL: MFCD00001904 Clé InChI: WMGVPDQNPUQRND-UHFFFAOYSA-N Synonyme: 2-methylbenzyl cyanide,2-o-tolyl acetonitrile,o-tolylacetonitrile,2-methylphenylacetonitrile,o-methylphenylacetonitrile,o-xylyl cyanide,o-methylbenzyl cyanide,acetonitrile, o-tolyl,benzeneacetonitrile, 2-methyl,2-2-methylphenyl acetonitrile CID PubChem: 31155 ChEBI: CHEBI:27982 Nom IUPAC: 2-(2-methylphenyl)acetonitrile SMILES: CC1=CC=CC=C1CC#N

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Poids moléculaire (g/mol)	131.178
Synonyme	2-methylbenzyl cyanide,2-o-tolyl acetonitrile,o-tolylacetonitrile,2-methylphenylacetonitrile,o-methylphenylacetonitrile,o-xylyl cyanide,o-methylbenzyl cyanide,acetonitrile, o-tolyl,benzeneacetonitrile, 2-methyl,2-2-methylphenyl acetonitrile
Numéro MDL	MFCD00001904
CAS	22364-68-7
CID PubChem	31155
ChEBI	CHEBI:27982
Nom IUPAC	2-(2-methylphenyl)acetonitrile
Clé InChI	WMGVPDQNPUQRND-UHFFFAOYSA-N
SMILES	CC1=CC=CC=C1CC#N
Formule moléculaire	C9H9N

alpha-Cyano-o-tolunitrile, 80%, Thermo Scientific™

CAS: 3759-28-2 Formule moléculaire: C9H6N2 Poids moléculaire (g/mol): 142.16 Numéro MDL: MFCD00001895 Clé InChI: GKHSEDFDYXZGCG-UHFFFAOYSA-N Synonyme: 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 CID PubChem: 77368 Nom IUPAC: 2-(cyanomethyl)benzonitrile SMILES: N#CCC1=CC=CC=C1C#N

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Poids moléculaire (g/mol)	142.16
Synonyme	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
Numéro MDL	MFCD00001895
CAS	3759-28-2
CID PubChem	77368
Nom IUPAC	2-(cyanomethyl)benzonitrile
Clé InChI	GKHSEDFDYXZGCG-UHFFFAOYSA-N
SMILES	N#CCC1=CC=CC=C1C#N
Formule moléculaire	C9H6N2

4-Iodophenylacetonitrile, 97%

CAS: 51628-12-7 Formule moléculaire: C8H6IN Poids moléculaire (g/mol): 243.047 Numéro MDL: MFCD00060306 Clé InChI: PNXWQTYSBFGIFD-UHFFFAOYSA-N Synonyme: 4-iodophenylacetonitrile,2-4-iodophenyl acetonitrile,4-iodobenzyl cyanide,4-iodophenyl acetonitrile,benzeneacetonitrile, 4-iodo,p-iodobenzylcyanide,pubchem19992,acmc-1asuk,4-cyanomethyl phenyl iodide,4-iodo-phenyl-acetonitrile CID PubChem: 142866 Nom IUPAC: 2-(4-iodophenyl)acetonitrile SMILES: C1=CC(=CC=C1CC#N)I

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Poids moléculaire (g/mol)	243.047
Synonyme	4-iodophenylacetonitrile,2-4-iodophenyl acetonitrile,4-iodobenzyl cyanide,4-iodophenyl acetonitrile,benzeneacetonitrile, 4-iodo,p-iodobenzylcyanide,pubchem19992,acmc-1asuk,4-cyanomethyl phenyl iodide,4-iodo-phenyl-acetonitrile
Numéro MDL	MFCD00060306
CAS	51628-12-7
CID PubChem	142866
Nom IUPAC	2-(4-iodophenyl)acetonitrile
Clé InChI	PNXWQTYSBFGIFD-UHFFFAOYSA-N
SMILES	C1=CC(=CC=C1CC#N)I
Formule moléculaire	C8H6IN

1-Bromobenzyl methyl ether, 98%

CAS: 52711-30-5 Formule moléculaire: C₈H₉BrO Poids moléculaire (g/mol): 201.06 Numéro MDL: MFCD03790887 Clé InChI: QFAZLCRHLRJNAW-UHFFFAOYSA-N Synonyme: 1-bromo-2-methoxymethyl benzene,2-bromobenzyl methyl ether,acmc-20ag76,methyl 2-bromobenzyl ether,1-methoxymethyl-2-bromobenzene,2-bromobenzyl alcohol, methyl ether,benzene,1-bromo-2-methoxymethyl CID PubChem: 12927162 Nom IUPAC: 1-bromo-2-(methoxymethyl)benzene SMILES: COCC1=CC=CC=C1Br

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Poids moléculaire (g/mol)	201.06
Synonyme	1-bromo-2-methoxymethyl benzene,2-bromobenzyl methyl ether,acmc-20ag76,methyl 2-bromobenzyl ether,1-methoxymethyl-2-bromobenzene,2-bromobenzyl alcohol, methyl ether,benzene,1-bromo-2-methoxymethyl
Numéro MDL	MFCD03790887
CAS	52711-30-5
CID PubChem	12927162
Nom IUPAC	1-bromo-2-(methoxymethyl)benzene
Clé InChI	QFAZLCRHLRJNAW-UHFFFAOYSA-N
SMILES	COCC1=CC=CC=C1Br
Formule moléculaire	C₈H₉BrO

2-Fluorophenylacetonitrile, 97%

CAS: 326-62-5 Formule moléculaire: C8H6FN Poids moléculaire (g/mol): 135.14 Numéro MDL: MFCD00001897 Clé InChI: DAVJMKMVLKOQQC-UHFFFAOYSA-N Synonyme: 2-fluorophenylacetonitrile,2-fluorobenzyl cyanide,2-2-fluorophenyl acetonitrile,benzeneacetonitrile, 2-fluoro,o-fluorophenylacetonitrile,o-fluorobenzyl cyanide,2-fluorophenyl acetonitrile,acetonitrile, o-fluorophenyl,2-2-fluorophenyl ethanenitrile,2-fluorobenzeneacetonitrile CID PubChem: 67592 Nom IUPAC: 2-(2-fluorophenyl)acetonitrile SMILES: FC1=CC=CC=C1CC#N

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Poids moléculaire (g/mol)	135.14
Synonyme	2-fluorophenylacetonitrile,2-fluorobenzyl cyanide,2-2-fluorophenyl acetonitrile,benzeneacetonitrile, 2-fluoro,o-fluorophenylacetonitrile,o-fluorobenzyl cyanide,2-fluorophenyl acetonitrile,acetonitrile, o-fluorophenyl,2-2-fluorophenyl ethanenitrile,2-fluorobenzeneacetonitrile
Numéro MDL	MFCD00001897
CAS	326-62-5
CID PubChem	67592
Nom IUPAC	2-(2-fluorophenyl)acetonitrile
Clé InChI	DAVJMKMVLKOQQC-UHFFFAOYSA-N
SMILES	FC1=CC=CC=C1CC#N
Formule moléculaire	C8H6FN

4-Hydroxybenzyl alcohol, 97%

CAS: 623-05-2 Formule moléculaire: C₇H₈O₂ Poids moléculaire (g/mol): 124.14 Clé InChI: BVJSUAQZOZWCKN-UHFFFAOYSA-N Synonyme: 4-hydroxybenzyl alcohol,4-hydroxymethyl phenol,p-hydroxybenzyl alcohol,p-methylolphenol,4-methylolphenol,4-hydroxybenzenemethanol,benzenemethanol, 4-hydroxy,p-hydroxymethyl phenol,gastrodigenin,4-hydroxybenzylalcohol CID PubChem: 125 ChEBI: CHEBI:67410 Nom IUPAC: 4-(hydroxymethyl)phenol SMILES: C1=CC(=CC=C1CO)O

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Poids moléculaire (g/mol)	124.14
Synonyme	4-hydroxybenzyl alcohol,4-hydroxymethyl phenol,p-hydroxybenzyl alcohol,p-methylolphenol,4-methylolphenol,4-hydroxybenzenemethanol,benzenemethanol, 4-hydroxy,p-hydroxymethyl phenol,gastrodigenin,4-hydroxybenzylalcohol
CAS	623-05-2
CID PubChem	125
ChEBI	CHEBI:67410
Nom IUPAC	4-(hydroxymethyl)phenol
Clé InChI	BVJSUAQZOZWCKN-UHFFFAOYSA-N
SMILES	C1=CC(=CC=C1CO)O
Formule moléculaire	C₇H₈O₂

2-Fluoro-5-(trifluoromethoxy)benzyl bromide, 97%

CAS: 86256-24-8 Formule moléculaire: C8H5BrF4O Poids moléculaire (g/mol): 273.025 Numéro MDL: MFCD04115890 Clé InChI: KOISGBFWQAPLFE-UHFFFAOYSA-N Synonyme: 2-fluoro-5-trifluoromethoxy benzyl bromide,2-bromomethyl-1-fluoro-4-trifluoromethoxy benzene,1-bromomethyl-2-fluoro-5-trifluoromethoxy benzene CID PubChem: 2783326 Nom IUPAC: 2-(bromomethyl)-1-fluoro-4-(trifluoromethoxy)benzene SMILES: C1=CC(=C(C=C1OC(F)(F)F)CBr)F

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Poids moléculaire (g/mol)	273.025
Synonyme	2-fluoro-5-trifluoromethoxy benzyl bromide,2-bromomethyl-1-fluoro-4-trifluoromethoxy benzene,1-bromomethyl-2-fluoro-5-trifluoromethoxy benzene
Numéro MDL	MFCD04115890
CAS	86256-24-8
CID PubChem	2783326
Nom IUPAC	2-(bromomethyl)-1-fluoro-4-(trifluoromethoxy)benzene
Clé InChI	KOISGBFWQAPLFE-UHFFFAOYSA-N
SMILES	C1=CC(=C(C=C1OC(F)(F)F)CBr)F
Formule moléculaire	C8H5BrF4O

3-Bromophenylacetonitrile, 97%

CAS: 31938-07-5 Formule moléculaire: C8H6BrN Poids moléculaire (g/mol): 196.047 Numéro MDL: MFCD00001906 Clé InChI: UUZYFBXKWIQKTF-UHFFFAOYSA-N Synonyme: 3-bromophenylacetonitrile,3-bromobenzyl cyanide,2-3-bromophenyl acetonitrile,m-bromobenzyl cyanide,benzeneacetonitrile, 3-bromo,3-bromobenzylcyanide,3-bromobenzeneacetonitrile,3-bromophenyl acetonitrile,m-bromophenylacetonitrile,2-3-bromophenyl ethanenitrile CID PubChem: 36023 Nom IUPAC: 2-(3-bromophenyl)acetonitrile SMILES: C1=CC(=CC(=C1)Br)CC#N

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Poids moléculaire (g/mol)	196.047
Synonyme	3-bromophenylacetonitrile,3-bromobenzyl cyanide,2-3-bromophenyl acetonitrile,m-bromobenzyl cyanide,benzeneacetonitrile, 3-bromo,3-bromobenzylcyanide,3-bromobenzeneacetonitrile,3-bromophenyl acetonitrile,m-bromophenylacetonitrile,2-3-bromophenyl ethanenitrile
Numéro MDL	MFCD00001906
CAS	31938-07-5
CID PubChem	36023
Nom IUPAC	2-(3-bromophenyl)acetonitrile
Clé InChI	UUZYFBXKWIQKTF-UHFFFAOYSA-N
SMILES	C1=CC(=CC(=C1)Br)CC#N
Formule moléculaire	C8H6BrN

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