Benzene and substituted derivatives

Benzene is an aromatic organic molecule composed of six carbon atoms and six hydrogen atoms that form a ring. Includes substituted derivative compounds.

1 – 15 of 43,811 results

Thermo Scientific Chemicals Sodium salicylate, 99%

CAS: 54-21-7 Molecular Formula: C7H5NaO3 Molecular Weight (g/mol): 160.104 MDL Number: MFCD00002440 InChI Key: ABBQHOQBGMUPJH-UHFFFAOYSA-M Synonym: sodium salicylate,sodium 2-hydroxybenzoate,salsonin,clin,enterosalicyl,enterosalil,entrosalyl,glutosalyl,kerasalicyl,magsalyl PubChem CID: 16760658 ChEBI: CHEBI:9180 IUPAC Name: sodium;2-hydroxybenzoate SMILES: C1=CC=C(C(=C1)C(=O)[O-])O.[Na+]

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PubChem CID	16760658
CAS	54-21-7
Molecular Weight (g/mol)	160.104
ChEBI	CHEBI:9180
MDL Number	MFCD00002440
SMILES	C1=CC=C(C(=C1)C(=O)[O-])O.[Na+]
Synonym	sodium salicylate,sodium 2-hydroxybenzoate,salsonin,clin,enterosalicyl,enterosalil,entrosalyl,glutosalyl,kerasalicyl,magsalyl
IUPAC Name	sodium;2-hydroxybenzoate
InChI Key	ABBQHOQBGMUPJH-UHFFFAOYSA-M
Molecular Formula	C7H5NaO3

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Sodium Salicylate (Small Crystals, Free Flowing/USP), Fisher Chemical™

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Specifications

PubChem CID	16760658
CAS	54-21-7
Molecular Weight (g/mol)	160.104
ChEBI	CHEBI:9180
MDL Number	MFCD00002440
SMILES	C1=CC=C(C(=C1)C(=O)[O-])O.[Na+]
Synonym	sodium salicylate,sodium 2-hydroxybenzoate,salsonin,clin,enterosalicyl,enterosalil,entrosalyl,glutosalyl,kerasalicyl,magsalyl
IUPAC Name	sodium;2-hydroxybenzoate
InChI Key	ABBQHOQBGMUPJH-UHFFFAOYSA-M
Molecular Formula	C7H5NaO3

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Fisher Scientific 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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Sodium Salicylate (Powder/Certified), Fisher Chemical

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Specifications

PubChem CID	16760658
CAS	54-21-7
Molecular Weight (g/mol)	160.104
ChEBI	CHEBI:9180
MDL Number	MFCD00002440
SMILES	C1=CC=C(C(=C1)C(=O)[O-])O.[Na+]
Synonym	sodium salicylate,sodium 2-hydroxybenzoate,salsonin,clin,enterosalicyl,enterosalil,entrosalyl,glutosalyl,kerasalicyl,magsalyl
IUPAC Name	sodium;2-hydroxybenzoate
InChI Key	ABBQHOQBGMUPJH-UHFFFAOYSA-M
Molecular Formula	C7H5NaO3

Thermo Scientific Chemicals 2-Fluorobenzyl bromide, 98%

CAS: 446-48-0 Molecular Formula: C₇H₆BrF Molecular Weight (g/mol): 189.03 MDL Number: MFCD00000324 InChI Key: FFWQLZFIMNTUCZ-UHFFFAOYSA-N Synonym: 2-fluorobenzyl bromide,1-bromomethyl-2-fluorobenzene,2-fluorobenzylbromide,o-fluorobenzyl bromide,alpha-bromo-o-fluorotoluene,alpha-bromo-2-fluorotoluene,2-fluoro-benzyl bromide,1-bromomethyl-2-fluoro-benzene,benzene, 1-bromomethyl-2-fluoro,2-fluoro-benzylbromide PubChem CID: 67968 IUPAC Name: 1-(bromomethyl)-2-fluorobenzene SMILES: C1=CC=C(C(=C1)CBr)F

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PubChem CID	67968
CAS	446-48-0
Molecular Weight (g/mol)	189.03
MDL Number	MFCD00000324
SMILES	C1=CC=C(C(=C1)CBr)F
Synonym	2-fluorobenzyl bromide,1-bromomethyl-2-fluorobenzene,2-fluorobenzylbromide,o-fluorobenzyl bromide,alpha-bromo-o-fluorotoluene,alpha-bromo-2-fluorotoluene,2-fluoro-benzyl bromide,1-bromomethyl-2-fluoro-benzene,benzene, 1-bromomethyl-2-fluoro,2-fluoro-benzylbromide
IUPAC Name	1-(bromomethyl)-2-fluorobenzene
InChI Key	FFWQLZFIMNTUCZ-UHFFFAOYSA-N
Molecular Formula	C₇H₆BrF

Thermo Scientific Chemicals Methyl 2-fluorophenylacetate, 99%, Thermo Scientific™

CAS: 57486-67-6 Molecular Formula: C9H9FO2 Molecular Weight (g/mol): 168.17 MDL Number: MFCD00800605 InChI Key: TWXVEZBPKFIMBB-UHFFFAOYSA-N Synonym: methyl 2-2-fluorophenyl acetate,methyl 2-fluorophenyl acetate,methyl 2-fluorophenylacetate,2-fluorophenylacetic acid methyl ester,benzeneacetic acid, 2-fluoro-, methyl ester,2-fluoro-phenyl-acetic acid methyl ester,methyl 2-2-fluorophenyl ethanoate,2-fluoro-phenylacetic acid methyl ester,2-2-fluorophenyl acetic acid methyl ester PubChem CID: 2733230 IUPAC Name: methyl 2-(2-fluorophenyl)acetate SMILES: COC(=O)CC1=CC=CC=C1F

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PubChem CID	2733230
CAS	57486-67-6
Molecular Weight (g/mol)	168.17
MDL Number	MFCD00800605
SMILES	COC(=O)CC1=CC=CC=C1F
Synonym	methyl 2-2-fluorophenyl acetate,methyl 2-fluorophenyl acetate,methyl 2-fluorophenylacetate,2-fluorophenylacetic acid methyl ester,benzeneacetic acid, 2-fluoro-, methyl ester,2-fluoro-phenyl-acetic acid methyl ester,methyl 2-2-fluorophenyl ethanoate,2-fluoro-phenylacetic acid methyl ester,2-2-fluorophenyl acetic acid methyl ester
IUPAC Name	methyl 2-(2-fluorophenyl)acetate
InChI Key	TWXVEZBPKFIMBB-UHFFFAOYSA-N
Molecular Formula	C9H9FO2

Thermo Scientific Chemicals Cumyl hydroperoxide, 80%

CAS: 80-15-9 Molecular Formula: C9H12O2 Molecular Weight (g/mol): 152.19 MDL Number: MFCD00002129 InChI Key: YQHLDYVWEZKEOX-UHFFFAOYSA-N Synonym: cumene hydroperoxide,cumyl hydroperoxide,hydroperoxide, 1-methyl-1-phenylethyl,cumenyl hydroperoxide,alpha,alpha-dimethylbenzyl hydroperoxide,cumolhydroperoxid,7-cumyl hydroperoxide,cumolhydroperoxide,cument hydroperoxide,hydroperoxyde de cumene PubChem CID: 6629 ChEBI: CHEBI:78673 SMILES: CC(C)(OO)C1=CC=CC=C1

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PubChem CID	6629
CAS	80-15-9
Molecular Weight (g/mol)	152.19
ChEBI	CHEBI:78673
MDL Number	MFCD00002129
SMILES	CC(C)(OO)C1=CC=CC=C1
Synonym	cumene hydroperoxide,cumyl hydroperoxide,hydroperoxide, 1-methyl-1-phenylethyl,cumenyl hydroperoxide,alpha,alpha-dimethylbenzyl hydroperoxide,cumolhydroperoxid,7-cumyl hydroperoxide,cumolhydroperoxide,cument hydroperoxide,hydroperoxyde de cumene
InChI Key	YQHLDYVWEZKEOX-UHFFFAOYSA-N
Molecular Formula	C9H12O2

Thermo Scientific Chemicals Tris(dibenzylideneacetone)dipalladium-chloroform adduct, 97%

CAS: 52522-40-4 Molecular Formula: C52H43Cl3O3Pd2 Molecular Weight (g/mol): 1035.10 MDL Number: MFCD00075479 InChI Key: LNAMMBFJMYMQTO-UHFFFAOYSA-N Synonym: tris dibenzylideneacetone dipalladium-chloroform adduct,tris dibenylideneacetone dipalladium-chloroform,tris dibenzylideneacetone dipalladium 0 chloroform adduct,tris dibenzylideneacetone dipalladium 0-chloroform adduct,tris dibenzylideneacetone dipalladium chloroform adduct,tris dibenzylideneacetone dipalladium-chloroform,pd2 dba 3 chcl3,tris dibenzylideneacetone chloroform-di-palladium 0,tris dibenzylideneacetone dipalladium chloroform complex PubChem CID: 11029508 IUPAC Name: chloroform;(1E,4E)-1,5-diphenylpenta-1,4-dien-3-one;palladium SMILES: [Pd].[Pd].ClC(Cl)Cl.O=C(C=CC1=CC=CC=C1)C=CC1=CC=CC=C1.O=C(C=CC1=CC=CC=C1)C=CC1=CC=CC=C1.O=C(C=CC1=CC=CC=C1)C=CC1=CC=CC=C1

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Specifications

PubChem CID	11029508
CAS	52522-40-4
Molecular Weight (g/mol)	1035.10
MDL Number	MFCD00075479
SMILES	[Pd].[Pd].ClC(Cl)Cl.O=C(C=CC1=CC=CC=C1)C=CC1=CC=CC=C1.O=C(C=CC1=CC=CC=C1)C=CC1=CC=CC=C1.O=C(C=CC1=CC=CC=C1)C=CC1=CC=CC=C1
Synonym	tris dibenzylideneacetone dipalladium-chloroform adduct,tris dibenylideneacetone dipalladium-chloroform,tris dibenzylideneacetone dipalladium 0 chloroform adduct,tris dibenzylideneacetone dipalladium 0-chloroform adduct,tris dibenzylideneacetone dipalladium chloroform adduct,tris dibenzylideneacetone dipalladium-chloroform,pd2 dba 3 chcl3,tris dibenzylideneacetone chloroform-di-palladium 0,tris dibenzylideneacetone dipalladium chloroform complex
IUPAC Name	chloroform;(1E,4E)-1,5-diphenylpenta-1,4-dien-3-one;palladium
InChI Key	LNAMMBFJMYMQTO-UHFFFAOYSA-N
Molecular Formula	C52H43Cl3O3Pd2

Thermo Scientific Chemicals 4-Hydroxy-3-methoxybenzyl alcohol, 99%

CAS: 498-00-0 Molecular Formula: C8H10O3 Molecular Weight (g/mol): 154.17 MDL Number: MFCD00004659 InChI Key: ZENOXNGFMSCLLL-UHFFFAOYSA-N Synonym: vanillyl alcohol,4-hydroxy-3-methoxybenzyl alcohol,4-hydroxymethyl-2-methoxyphenol,vanillin alcohol,vanillic alcohol,4-hydroxy-3-methoxybenzenemethanol,benzenemethanol, 4-hydroxy-3-methoxy,vanillol,4-hydroxy-3-methoxybenzylalcohol,4-hydroxy-3-methoxyphenylmethanol PubChem CID: 62348 ChEBI: CHEBI:18353 IUPAC Name: 4-(hydroxymethyl)-2-methoxyphenol SMILES: COC1=CC(CO)=CC=C1O

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PubChem CID	62348
CAS	498-00-0
Molecular Weight (g/mol)	154.17
ChEBI	CHEBI:18353
MDL Number	MFCD00004659
SMILES	COC1=CC(CO)=CC=C1O
Synonym	vanillyl alcohol,4-hydroxy-3-methoxybenzyl alcohol,4-hydroxymethyl-2-methoxyphenol,vanillin alcohol,vanillic alcohol,4-hydroxy-3-methoxybenzenemethanol,benzenemethanol, 4-hydroxy-3-methoxy,vanillol,4-hydroxy-3-methoxybenzylalcohol,4-hydroxy-3-methoxyphenylmethanol
IUPAC Name	4-(hydroxymethyl)-2-methoxyphenol
InChI Key	ZENOXNGFMSCLLL-UHFFFAOYSA-N
Molecular Formula	C8H10O3

Thermo Scientific Chemicals 2,4,6-Trimethoxybenzaldehyde, 98%

CAS: 830-79-5 Molecular Formula: C₁₀H₁₂O₄ Molecular Weight (g/mol): 196.2 MDL Number: MFCD00003313 InChI Key: CRBZVDLXAIFERF-UHFFFAOYSA-N Synonym: benzaldehyde, 2,4,6-trimethoxy,2,4,6-trimethoxybenz aldehyde,pubchem8264,acmc-1cuhn,ksc490m2h,2,4,6-trimethoxy-benzaldehyde,2,4,6-trimethoxybenz-aldehyde,2,4,6-trimethoxy benz aldehyde,crbzvdlxaiferf-uhfffaoysa,1-formyl-2,4,6-trimethoxybenzene PubChem CID: 70019 IUPAC Name: 2,4,6-trimethoxybenzaldehyde SMILES: COC1=CC(=C(C(=C1)OC)C=O)OC

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PubChem CID	70019
CAS	830-79-5
Molecular Weight (g/mol)	196.2
MDL Number	MFCD00003313
SMILES	COC1=CC(=C(C(=C1)OC)C=O)OC
Synonym	benzaldehyde, 2,4,6-trimethoxy,2,4,6-trimethoxybenz aldehyde,pubchem8264,acmc-1cuhn,ksc490m2h,2,4,6-trimethoxy-benzaldehyde,2,4,6-trimethoxybenz-aldehyde,2,4,6-trimethoxy benz aldehyde,crbzvdlxaiferf-uhfffaoysa,1-formyl-2,4,6-trimethoxybenzene
IUPAC Name	2,4,6-trimethoxybenzaldehyde
InChI Key	CRBZVDLXAIFERF-UHFFFAOYSA-N
Molecular Formula	C₁₀H₁₂O₄

Thermo Scientific Chemicals 3-Amino-4-methylphenylboronic acid, 98%, Thermo Scientific™

CAS: 22237-12-3 Molecular Formula: C7H11BClNO2 Molecular Weight (g/mol): 187.43 MDL Number: MFCD01632201 InChI Key: BKFDOPYYSBQWIK-UHFFFAOYSA-N Synonym: 3-amino-4-methylphenyl boronic acid,3-amino-4-methylbenzeneboronic acid,3-amino-4-methyl-phenyl boronic acid,3-amino-p-tolylboronic acid,boronic acid, 3-amino-4-methylphenyl,acmc-20agxu,pubchem1745,3-amino-4-methylphenylboranic acid,3-amino4methyl phenyl boronic acid PubChem CID: 2737803 SMILES: Cl.CC1=CC=C(C=C1N)B(O)O

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PubChem CID	2737803
CAS	22237-12-3
Molecular Weight (g/mol)	187.43
MDL Number	MFCD01632201
SMILES	Cl.CC1=CC=C(C=C1N)B(O)O
Synonym	3-amino-4-methylphenyl boronic acid,3-amino-4-methylbenzeneboronic acid,3-amino-4-methyl-phenyl boronic acid,3-amino-p-tolylboronic acid,boronic acid, 3-amino-4-methylphenyl,acmc-20agxu,pubchem1745,3-amino-4-methylphenylboranic acid,3-amino4methyl phenyl boronic acid
InChI Key	BKFDOPYYSBQWIK-UHFFFAOYSA-N
Molecular Formula	C7H11BClNO2

Thermo Scientific Chemicals 3-Methoxyphenyl isocyanate, 99%

CAS: 18908-07-1 Molecular Formula: C₈H₇NO₂ Molecular Weight (g/mol): 149.15 MDL Number: MFCD00002019 InChI Key: NPOVTGVGOBJZPY-UHFFFAOYSA-N Synonym: 3-methoxyphenyl isocyanate,benzene, 1-isocyanato-3-methoxy,isocyanic acid 3-methoxyphenyl ester,3-isocyanatoanisole,3-methoxyphenylisocyanate,m-methoxyphenyl isocyanate,1-isocyanato-3-methoxy-benzene,3-methoxybenzenisocyanate,m-anisyl isocyanate,m-methoxyphenylisocyanate PubChem CID: 87843 IUPAC Name: 1-isocyanato-3-methoxybenzene SMILES: COC1=CC=CC(=C1)N=C=O

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PubChem CID	87843
CAS	18908-07-1
Molecular Weight (g/mol)	149.15
MDL Number	MFCD00002019
SMILES	COC1=CC=CC(=C1)N=C=O
Synonym	3-methoxyphenyl isocyanate,benzene, 1-isocyanato-3-methoxy,isocyanic acid 3-methoxyphenyl ester,3-isocyanatoanisole,3-methoxyphenylisocyanate,m-methoxyphenyl isocyanate,1-isocyanato-3-methoxy-benzene,3-methoxybenzenisocyanate,m-anisyl isocyanate,m-methoxyphenylisocyanate
IUPAC Name	1-isocyanato-3-methoxybenzene
InChI Key	NPOVTGVGOBJZPY-UHFFFAOYSA-N
Molecular Formula	C₈H₇NO₂

Thermo Scientific Chemicals 4-Fluorobenzylamine, 97%

CAS: 140-75-0 InChI Key: IIFVWLUQBAIPMJ-UHFFFAOYSA-N Synonym: 4-fluorobenzylamine,4-fluorophenyl methanamine,benzenemethanamine, 4-fluoro,p-fluorobenzylamine,benzylamine, p-fluoro,p-fluorobenzyl amine,4-fluoro-benzylamine,1-4-fluorophenyl methanamine,4-fluorobenzyl amine,chembl12392 PubChem CID: 67326 IUPAC Name: (4-fluorophenyl)methanamine SMILES: C1=CC(=CC=C1CN)F

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PubChem CID	67326
CAS	140-75-0
SMILES	C1=CC(=CC=C1CN)F
Synonym	4-fluorobenzylamine,4-fluorophenyl methanamine,benzenemethanamine, 4-fluoro,p-fluorobenzylamine,benzylamine, p-fluoro,p-fluorobenzyl amine,4-fluoro-benzylamine,1-4-fluorophenyl methanamine,4-fluorobenzyl amine,chembl12392
IUPAC Name	(4-fluorophenyl)methanamine
InChI Key	IIFVWLUQBAIPMJ-UHFFFAOYSA-N

Thermo Scientific Chemicals trans-beta-Nitrostyrene, 97+%

CAS: 5153-67-3 Molecular Formula: C8H7NO2 Molecular Weight (g/mol): 149.15 MDL Number: MFCD00007402 InChI Key: PIAOLBVUVDXHHL-VOTSOKGWSA-N Synonym: trans-beta-nitrostyrene,2-nitrovinyl benzene,e-2-nitrovinyl benzene,beta-nitrostyrene,2-nitro-1-phenylethylene,e-beta-nitrostyrene,2-nitroethenyl benzene,1-phenyl-2-nitroethene,beta-nitrosytrene,benzene, 2-nitroethenyl PubChem CID: 5284459 IUPAC Name: [(E)-2-nitroethenyl]benzene SMILES: [O-][N+](=O)\C=C\C1=CC=CC=C1

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PubChem CID	5284459
CAS	5153-67-3
Molecular Weight (g/mol)	149.15
MDL Number	MFCD00007402
SMILES	[O-][N+](=O)\C=C\C1=CC=CC=C1
Synonym	trans-beta-nitrostyrene,2-nitrovinyl benzene,e-2-nitrovinyl benzene,beta-nitrostyrene,2-nitro-1-phenylethylene,e-beta-nitrostyrene,2-nitroethenyl benzene,1-phenyl-2-nitroethene,beta-nitrosytrene,benzene, 2-nitroethenyl
IUPAC Name	[(E)-2-nitroethenyl]benzene
InChI Key	PIAOLBVUVDXHHL-VOTSOKGWSA-N
Molecular Formula	C8H7NO2

Thermo Scientific Chemicals 4-Bromophenylacetic acid, 99%

CAS: 1878-68-8 Molecular Formula: C8H7BrO2 Molecular Weight (g/mol): 215.05 MDL Number: MFCD00004342 InChI Key: QOWSWEBLNVACCL-UHFFFAOYSA-N Synonym: 4-bromophenylacetic acid,2-4-bromophenyl acetic acid,4-bromophenyl acetic acid,p-bromophenylacetic acid,4-bromobenzeneacetic acid,benzeneacetic acid, 4-bromo,p-bromophenyl acetic acid,acetic acid, p-bromophenyl,p-bromphenylessigsaure german PubChem CID: 74654 ChEBI: CHEBI:1790 IUPAC Name: 2-(4-bromophenyl)acetic acid SMILES: OC(=O)CC1=CC=C(Br)C=C1

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Specifications

PubChem CID	74654
CAS	1878-68-8
Molecular Weight (g/mol)	215.05
ChEBI	CHEBI:1790
MDL Number	MFCD00004342
SMILES	OC(=O)CC1=CC=C(Br)C=C1
Synonym	4-bromophenylacetic acid,2-4-bromophenyl acetic acid,4-bromophenyl acetic acid,p-bromophenylacetic acid,4-bromobenzeneacetic acid,benzeneacetic acid, 4-bromo,p-bromophenyl acetic acid,acetic acid, p-bromophenyl,p-bromphenylessigsaure german
IUPAC Name	2-(4-bromophenyl)acetic acid
InChI Key	QOWSWEBLNVACCL-UHFFFAOYSA-N
Molecular Formula	C8H7BrO2

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Benzene and substituted derivatives

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Fisher Scientific Benzyl Alcohol (Certified ACS), Fisher Chemical™ GSA/VA ContractAvailable on GSA/VA contract for Federal Government customers.Learn More

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