Benzenoids

Organic compounds that are derived from or have a benzene group in their molecular structure. Benzene is an aromatic organic molecule composed of 6 carbon atoms and 6 hydrogen atoms that form a ring. Includes derivatives and substituted molecules.

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2,281 – 2,295 of 78,692 results

2,281

5-(2-Bromophenyl)-1-methyl-3-(trifluoromethyl)-1H-pyrazole, ≥97%, Thermo Scientific™

CAS: 906352-89-4 Molecular Formula: C11H8BrF3N2 Molecular Weight (g/mol): 305.098 MDL Number: MFCD09817512 InChI Key: UKDUPCWWWMHDRH-UHFFFAOYSA-N Synonym: 5-2-bromophenyl-1-methyl-3-trifluoromethyl-1h-pyrazole,5-2-bromophenyl-1-methyl-3-trifluoromethyl pyrazole PubChem CID: 24229660 IUPAC Name: 5-(2-bromophenyl)-1-methyl-3-(trifluoromethyl)pyrazole SMILES: CN1C(=CC(=N1)C(F)(F)F)C2=CC=CC=C2Br

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Specifications

PubChem CID	24229660
CAS	906352-89-4
Molecular Weight (g/mol)	305.098
MDL Number	MFCD09817512
SMILES	CN1C(=CC(=N1)C(F)(F)F)C2=CC=CC=C2Br
Synonym	5-2-bromophenyl-1-methyl-3-trifluoromethyl-1h-pyrazole,5-2-bromophenyl-1-methyl-3-trifluoromethyl pyrazole
IUPAC Name	5-(2-bromophenyl)-1-methyl-3-(trifluoromethyl)pyrazole
InChI Key	UKDUPCWWWMHDRH-UHFFFAOYSA-N
Molecular Formula	C11H8BrF3N2

2,282

4-Amino-2-bromobenzonitrile, 95%

CAS: 53312-82-6 Molecular Formula: C7H5BrN2 Molecular Weight (g/mol): 197.04 MDL Number: MFCD03695814 InChI Key: OSYGPHDNNWRFJO-UHFFFAOYSA-N Synonym: 2-bromo-4-aminobenzonitrile,ksc494a6n,benzonitrile, 4-amino-2-bromo PubChem CID: 824602 IUPAC Name: 4-amino-2-bromobenzonitrile SMILES: NC1=CC(Br)=C(C=C1)C#N

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Specifications

PubChem CID	824602
CAS	53312-82-6
Molecular Weight (g/mol)	197.04
MDL Number	MFCD03695814
SMILES	NC1=CC(Br)=C(C=C1)C#N
Synonym	2-bromo-4-aminobenzonitrile,ksc494a6n,benzonitrile, 4-amino-2-bromo
IUPAC Name	4-amino-2-bromobenzonitrile
InChI Key	OSYGPHDNNWRFJO-UHFFFAOYSA-N
Molecular Formula	C7H5BrN2

2,283

2-Amino-5-iodobenzoic acid, 98%

CAS: 5326-47-6 Molecular Formula: C7H6INO2 Molecular Weight (g/mol): 263.034 MDL Number: MFCD00007849 InChI Key: GOLGILSVWFKZRQ-UHFFFAOYSA-N Synonym: 5-iodoanthranilic acid,benzoic acid, 2-amino-5-iodo,5-iodoanthranil acid,anthranilic acid, 5-iodo,2-amino-5-iodo-benzoic acid,pubchem2543,5-iodo anthranilic acid,acmc-1ays8,2-amino-5-iodobenzoicacid,5-iodo-2-aminobenzoic acid PubChem CID: 72911 IUPAC Name: 2-amino-5-iodobenzoic acid SMILES: C1=CC(=C(C=C1I)C(=O)O)N

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Specifications

PubChem CID	72911
CAS	5326-47-6
Molecular Weight (g/mol)	263.034
MDL Number	MFCD00007849
SMILES	C1=CC(=C(C=C1I)C(=O)O)N
Synonym	5-iodoanthranilic acid,benzoic acid, 2-amino-5-iodo,5-iodoanthranil acid,anthranilic acid, 5-iodo,2-amino-5-iodo-benzoic acid,pubchem2543,5-iodo anthranilic acid,acmc-1ays8,2-amino-5-iodobenzoicacid,5-iodo-2-aminobenzoic acid
IUPAC Name	2-amino-5-iodobenzoic acid
InChI Key	GOLGILSVWFKZRQ-UHFFFAOYSA-N
Molecular Formula	C7H6INO2

2,284

3,5-Dibromoanthranilic acid, 98+%, Thermo Scientific™

CAS: 609-85-8 Molecular Formula: C7H5Br2NO2 Molecular Weight (g/mol): 294.93 MDL Number: MFCD00017087 InChI Key: WNABMWFLKQEGCP-UHFFFAOYSA-N Synonym: 3,5-dibromoanthranilic acid,2-amino-3,5-dibromobenzoicacid,3,5-dibromo-2-aminobenzoic acid,buttpark 89\07-50,2-amino-3,5-dibromo-benzoic acid,benzoic acid, 2-amino-3,5-dibromo,acmc-20ahts,pubchem3720,2-carboxy-4,6-dibromoaniline,ghl.pd_mitscher_leg0.1128 PubChem CID: 219491 IUPAC Name: 2-amino-3,5-dibromobenzoic acid SMILES: NC1=C(Br)C=C(Br)C=C1C(O)=O

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Specifications

PubChem CID	219491
CAS	609-85-8
Molecular Weight (g/mol)	294.93
MDL Number	MFCD00017087
SMILES	NC1=C(Br)C=C(Br)C=C1C(O)=O
Synonym	3,5-dibromoanthranilic acid,2-amino-3,5-dibromobenzoicacid,3,5-dibromo-2-aminobenzoic acid,buttpark 89\07-50,2-amino-3,5-dibromo-benzoic acid,benzoic acid, 2-amino-3,5-dibromo,acmc-20ahts,pubchem3720,2-carboxy-4,6-dibromoaniline,ghl.pd_mitscher_leg0.1128
IUPAC Name	2-amino-3,5-dibromobenzoic acid
InChI Key	WNABMWFLKQEGCP-UHFFFAOYSA-N
Molecular Formula	C7H5Br2NO2

2,285

2-(4-Methylperhydro-1,4-diazepin-1-yl)benzoic acid hydrochloride hemihydrate, 95%, Thermo Scientific™

CAS: 921938-77-4 Molecular Formula: C13H19ClN2O2 Molecular Weight (g/mol): 270.757 MDL Number: MFCD09065004 InChI Key: UCYNEWGETFFMQY-UHFFFAOYSA-N Synonym: 2-4-methyl-1,4-diazepan-1-yl benzoic acid hydrochloride,2-4-methyl-1,4-diazepan-1-yl benzoic acid hcl,2-4-methylhomopiperazin-1-yl benzoic acid hydrochloride hemihydrate,2-4-methyl-1,4-diazepan-1-yl benzoic acid-hydrogen chloride 1/1,2-4-methylperhydro-1,4-diazepin-1-yl benzoic acid hydrochloride 0.5 hydrate,benzoicacid, 2-hexahydro-4-methyl-1h-1,4-diazepin-1-yl-, hydrochloride 1:1,benzoicacid,2-hexahydro-4-methyl-1h-1,4-diazepin-1-yl-,hydrochloride 1:1 PubChem CID: 24229621 IUPAC Name: 2-(4-methyl-1,4-diazepan-1-yl)benzoic acid;hydrochloride SMILES: CN1CCCN(CC1)C2=CC=CC=C2C(=O)O.Cl

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Specifications

PubChem CID	24229621
CAS	921938-77-4
Molecular Weight (g/mol)	270.757
MDL Number	MFCD09065004
SMILES	CN1CCCN(CC1)C2=CC=CC=C2C(=O)O.Cl
Synonym	2-4-methyl-1,4-diazepan-1-yl benzoic acid hydrochloride,2-4-methyl-1,4-diazepan-1-yl benzoic acid hcl,2-4-methylhomopiperazin-1-yl benzoic acid hydrochloride hemihydrate,2-4-methyl-1,4-diazepan-1-yl benzoic acid-hydrogen chloride 1/1,2-4-methylperhydro-1,4-diazepin-1-yl benzoic acid hydrochloride 0.5 hydrate,benzoicacid, 2-hexahydro-4-methyl-1h-1,4-diazepin-1-yl-, hydrochloride 1:1,benzoicacid,2-hexahydro-4-methyl-1h-1,4-diazepin-1-yl-,hydrochloride 1:1
IUPAC Name	2-(4-methyl-1,4-diazepan-1-yl)benzoic acid;hydrochloride
InChI Key	UCYNEWGETFFMQY-UHFFFAOYSA-N
Molecular Formula	C13H19ClN2O2

2,286

2-Amino-3,4-dimethylbenzoic acid, 98+%

CAS: 50419-58-4 Molecular Formula: C9H11NO2 Molecular Weight (g/mol): 165.19 MDL Number: MFCD00130041 InChI Key: MUOBMUYSNYMSDM-UHFFFAOYSA-N Synonym: 2-amino-3,4-dimethyl-benzoic acid,3,4-dimethylanthranilic acid,benzoic acid, 2-amino-3,4-dimethyl,pubchem4683,acmc-1aomr,ksc272a3h,2-amino-3,4-dimethyl benzoic acid PubChem CID: 282450 IUPAC Name: 2-amino-3,4-dimethylbenzoic acid SMILES: CC1=CC=C(C(O)=O)C(N)=C1C

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Specifications

PubChem CID	282450
CAS	50419-58-4
Molecular Weight (g/mol)	165.19
MDL Number	MFCD00130041
SMILES	CC1=CC=C(C(O)=O)C(N)=C1C
Synonym	2-amino-3,4-dimethyl-benzoic acid,3,4-dimethylanthranilic acid,benzoic acid, 2-amino-3,4-dimethyl,pubchem4683,acmc-1aomr,ksc272a3h,2-amino-3,4-dimethyl benzoic acid
IUPAC Name	2-amino-3,4-dimethylbenzoic acid
InChI Key	MUOBMUYSNYMSDM-UHFFFAOYSA-N
Molecular Formula	C9H11NO2

2,287

2-Amino-6-bromobenzoic acid, 97+%

CAS: 20776-48-1 Molecular Formula: C7H6BrNO2 Molecular Weight (g/mol): 216.03 MDL Number: MFCD03618455 InChI Key: BNQPROAXWQCNKO-UHFFFAOYSA-N Synonym: 6-bromoanthranilic acid,3-bromo-2-carboxyaniline,benzoic acid, 2-amino-6-bromo,buttpark 49\07-50,2-amino-6-bromo-benzoic acid,ksc201s8r PubChem CID: 10560649 IUPAC Name: 2-amino-6-bromobenzoic acid SMILES: NC1=C(C(O)=O)C(Br)=CC=C1

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Specifications

PubChem CID	10560649
CAS	20776-48-1
Molecular Weight (g/mol)	216.03
MDL Number	MFCD03618455
SMILES	NC1=C(C(O)=O)C(Br)=CC=C1
Synonym	6-bromoanthranilic acid,3-bromo-2-carboxyaniline,benzoic acid, 2-amino-6-bromo,buttpark 49\07-50,2-amino-6-bromo-benzoic acid,ksc201s8r
IUPAC Name	2-amino-6-bromobenzoic acid
InChI Key	BNQPROAXWQCNKO-UHFFFAOYSA-N
Molecular Formula	C7H6BrNO2

2,288

3-Aminophthalic acid hydrochloride dihydrate, 96%

CAS: 1852533-96-0 Molecular Formula: C8H8ClNO4 Molecular Weight (g/mol): 217.605 MDL Number: MFCD00150282 InChI Key: ZBZAVEORKXFUQB-UHFFFAOYSA-N Synonym: 3-aminophthalic acid hydrochloride,1,2-benzenedicarboxylic acid, 3-amino-, hydrochloride,1,2-benzenedicarboxylic acid, 3-amino-, hydrochloride 1:1,phthalic acid, hydrochloride,1, 3-amino-, hydrochloride,3-aminobenzene-1,2-dicarboxylic acid hydrochloride,3-amino phthalic acid hydrochloride,phthalic acid, 3-amino-, hydrochloride,acmc-1b7k3,ghl.pd_mitscher_leg0.1315 PubChem CID: 81375 IUPAC Name: 3-aminophthalic acid;hydrochloride SMILES: C1=CC(=C(C(=C1)N)C(=O)O)C(=O)O.Cl

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Specifications

PubChem CID	81375
CAS	1852533-96-0
Molecular Weight (g/mol)	217.605
MDL Number	MFCD00150282
SMILES	C1=CC(=C(C(=C1)N)C(=O)O)C(=O)O.Cl
Synonym	3-aminophthalic acid hydrochloride,1,2-benzenedicarboxylic acid, 3-amino-, hydrochloride,1,2-benzenedicarboxylic acid, 3-amino-, hydrochloride 1:1,phthalic acid, hydrochloride,1, 3-amino-, hydrochloride,3-aminobenzene-1,2-dicarboxylic acid hydrochloride,3-amino phthalic acid hydrochloride,phthalic acid, 3-amino-, hydrochloride,acmc-1b7k3,ghl.pd_mitscher_leg0.1315
IUPAC Name	3-aminophthalic acid;hydrochloride
InChI Key	ZBZAVEORKXFUQB-UHFFFAOYSA-N
Molecular Formula	C8H8ClNO4

2,289

Methyl 2-hydroxy-3-methylbenzoate, 97%

CAS: 23287-26-5 Molecular Formula: C9H10O3 Molecular Weight (g/mol): 166.18 MDL Number: MFCD00020051 InChI Key: SUHLUMKZPUMAFP-UHFFFAOYSA-N Synonym: methyl 3-methylsalicylate,methyl o-cresotinate,benzoic acid, 2-hydroxy-3-methyl-, methyl ester,levegal pt,2-hydroxy-3-methylbenzoic acid methyl ester,2,3-cresotic acid, methyl ester,methyl-3-methylsalicylate,methyl 2-hydroxy-3-methyl-benzoate,methyl o-cresotate,3-methylsalicylic acid methyl ester PubChem CID: 31835 IUPAC Name: methyl 2-hydroxy-3-methylbenzoate SMILES: COC(=O)C1=CC=CC(C)=C1O

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Specifications

PubChem CID	31835
CAS	23287-26-5
Molecular Weight (g/mol)	166.18
MDL Number	MFCD00020051
SMILES	COC(=O)C1=CC=CC(C)=C1O
Synonym	methyl 3-methylsalicylate,methyl o-cresotinate,benzoic acid, 2-hydroxy-3-methyl-, methyl ester,levegal pt,2-hydroxy-3-methylbenzoic acid methyl ester,2,3-cresotic acid, methyl ester,methyl-3-methylsalicylate,methyl 2-hydroxy-3-methyl-benzoate,methyl o-cresotate,3-methylsalicylic acid methyl ester
IUPAC Name	methyl 2-hydroxy-3-methylbenzoate
InChI Key	SUHLUMKZPUMAFP-UHFFFAOYSA-N
Molecular Formula	C9H10O3

2,290

Methyl 3-aminosalicylate, 97%

CAS: 35748-34-6 Molecular Formula: C8H9NO3 Molecular Weight (g/mol): 167.16 MDL Number: MFCD09842614 InChI Key: OMWQHVRUXLRZRC-UHFFFAOYSA-N Synonym: 3-amino-2-hydroxybenzoic acid methyl ester,benzoic acid, 3-amino-2-hydroxy-, methyl ester,methyl 3-aminosalicylate,methyl3-amino-2-hydroxybenzoate,2-amino-6-methoxycarbonyl phenol,2-hydroxy-3-methoxycarbonyl aniline,methyl-m-aminosalicylat,acmc-209wuz,methyl-3-aminosalicylate,aminohydroxy-benzoic methyl ester PubChem CID: 12782444 IUPAC Name: methyl 3-amino-2-hydroxybenzoate SMILES: COC(=O)C1=C(O)C(N)=CC=C1

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Specifications

PubChem CID	12782444
CAS	35748-34-6
Molecular Weight (g/mol)	167.16
MDL Number	MFCD09842614
SMILES	COC(=O)C1=C(O)C(N)=CC=C1
Synonym	3-amino-2-hydroxybenzoic acid methyl ester,benzoic acid, 3-amino-2-hydroxy-, methyl ester,methyl 3-aminosalicylate,methyl3-amino-2-hydroxybenzoate,2-amino-6-methoxycarbonyl phenol,2-hydroxy-3-methoxycarbonyl aniline,methyl-m-aminosalicylat,acmc-209wuz,methyl-3-aminosalicylate,aminohydroxy-benzoic methyl ester
IUPAC Name	methyl 3-amino-2-hydroxybenzoate
InChI Key	OMWQHVRUXLRZRC-UHFFFAOYSA-N
Molecular Formula	C8H9NO3

2,291

Methyl 3-amino-4-hydroxybenzoate, 95%

CAS: 536-25-4 Molecular Formula: C8H9NO3 Molecular Weight (g/mol): 167.164 MDL Number: MFCD00017095 InChI Key: VNQABZCSYCTZMS-UHFFFAOYSA-N Synonym: orthocaine,orthoform,aminobenz,orthoderm,3-amino-4-hydroxybenzoic acid methyl ester,benzoic acid, 3-amino-4-hydroxy-, methyl ester,methyl m-amino-p-hydroxybenzoate,methyl 4-hydroxy-3-aminobenzoate,methyl 3-amino-4-hydroxybenzenecarboxylate,unii-jk16yi13qk PubChem CID: 10815 ChEBI: CHEBI:34904 IUPAC Name: methyl 3-amino-4-hydroxybenzoate SMILES: COC(=O)C1=CC(=C(C=C1)O)N

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Specifications

PubChem CID	10815
CAS	536-25-4
Molecular Weight (g/mol)	167.164
ChEBI	CHEBI:34904
MDL Number	MFCD00017095
SMILES	COC(=O)C1=CC(=C(C=C1)O)N
Synonym	orthocaine,orthoform,aminobenz,orthoderm,3-amino-4-hydroxybenzoic acid methyl ester,benzoic acid, 3-amino-4-hydroxy-, methyl ester,methyl m-amino-p-hydroxybenzoate,methyl 4-hydroxy-3-aminobenzoate,methyl 3-amino-4-hydroxybenzenecarboxylate,unii-jk16yi13qk
IUPAC Name	methyl 3-amino-4-hydroxybenzoate
InChI Key	VNQABZCSYCTZMS-UHFFFAOYSA-N
Molecular Formula	C8H9NO3

2,292

Ethylparaben, NF, 98-102%, Spectrum™ Chemical

CAS: 120-47-8 Molecular Formula: C9H10O3 Molecular Weight (g/mol): 166.18 InChI Key: NUVBSKCKDOMJSU-UHFFFAOYSA-N IUPAC Name: ethyl 4-hydroxybenzoate SMILES: CCOC(=O)C1=CC=C(O)C=C1

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Specifications

CAS	120-47-8
Molecular Weight (g/mol)	166.18
SMILES	CCOC(=O)C1=CC=C(O)C=C1
IUPAC Name	ethyl 4-hydroxybenzoate
InChI Key	NUVBSKCKDOMJSU-UHFFFAOYSA-N
Molecular Formula	C9H10O3

2,293

Methylparaben, FCC, 99-100.5%, Spectrum™ Chemical

CAS: 61-68-7 Molecular Formula: C15H15NO2 Molecular Weight (g/mol): 241.29 InChI Key: HYYBABOKPJLUIN-UHFFFAOYSA-N IUPAC Name: 2-[(2,3-dimethylphenyl)amino]benzoic acid SMILES: CC1=CC=CC(NC2=CC=CC=C2C(O)=O)=C1C

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Specifications

CAS	61-68-7
Molecular Weight (g/mol)	241.29
SMILES	CC1=CC=CC(NC2=CC=CC=C2C(O)=O)=C1C
IUPAC Name	2-[(2,3-dimethylphenyl)amino]benzoic acid
InChI Key	HYYBABOKPJLUIN-UHFFFAOYSA-N
Molecular Formula	C15H15NO2

2,294

Methyl 4-aminosalicylate, 97%, Thermo Scientific Chemicals

CAS: 4136-97-4 Molecular Formula: C8H9NO3 Molecular Weight (g/mol): 167.164 MDL Number: MFCD00088091 InChI Key: QQOXBFUTRLDXDP-UHFFFAOYSA-N Synonym: methyl 4-aminosalicylate,methyl p-aminosalicylate,pas methyl ester,p-aminosalicylic acid methyl ester,methyl 4-amino-2-hydroxybenzenecarboxylate,benzoic acid, 4-amino-2-hydroxy-, methyl ester,methyl 4-amino-2-hydroxy-benzoate,salicylic acid, amino-, methyl ester,4-aminosalicylic acid methyl ester,4-amino-2-hydroxy-benzoic acid methyl ester PubChem CID: 77787 ChEBI: CHEBI:35089 IUPAC Name: methyl 4-amino-2-hydroxybenzoate SMILES: COC(=O)C1=C(C=C(C=C1)N)O

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Specifications

PubChem CID	77787
CAS	4136-97-4
Molecular Weight (g/mol)	167.164
ChEBI	CHEBI:35089
MDL Number	MFCD00088091
SMILES	COC(=O)C1=C(C=C(C=C1)N)O
Synonym	methyl 4-aminosalicylate,methyl p-aminosalicylate,pas methyl ester,p-aminosalicylic acid methyl ester,methyl 4-amino-2-hydroxybenzenecarboxylate,benzoic acid, 4-amino-2-hydroxy-, methyl ester,methyl 4-amino-2-hydroxy-benzoate,salicylic acid, amino-, methyl ester,4-aminosalicylic acid methyl ester,4-amino-2-hydroxy-benzoic acid methyl ester
IUPAC Name	methyl 4-amino-2-hydroxybenzoate
InChI Key	QQOXBFUTRLDXDP-UHFFFAOYSA-N
Molecular Formula	C8H9NO3

2,295

Methyl 3,5-dibromo-2-hydroxybenzoate, 98%

CAS: 21702-79-4 Molecular Formula: C8H6Br2O3 Molecular Weight (g/mol): 309.94 MDL Number: MFCD00017534 InChI Key: KISQISIKTRRMOX-UHFFFAOYSA-N PubChem CID: 624217 IUPAC Name: methyl 3,5-dibromo-2-hydroxybenzoate SMILES: COC(=O)C1=CC(Br)=CC(Br)=C1O

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Specifications

PubChem CID	624217
CAS	21702-79-4
Molecular Weight (g/mol)	309.94
MDL Number	MFCD00017534
SMILES	COC(=O)C1=CC(Br)=CC(Br)=C1O
IUPAC Name	methyl 3,5-dibromo-2-hydroxybenzoate
InChI Key	KISQISIKTRRMOX-UHFFFAOYSA-N
Molecular Formula	C8H6Br2O3

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Ethylparaben, NF, 98-102%, Spectrum™ Chemical Small and Specialty Supplier PartnerSmall and/or specialty supplier based on Federal laws and SBA requirements.Learn More

Methylparaben, FCC, 99-100.5%, Spectrum™ Chemical Small and Specialty Supplier PartnerSmall and/or specialty supplier based on Federal laws and SBA requirements.Learn More

Ethylparaben, NF, 98-102%, Spectrum™ Chemical

Methylparaben, FCC, 99-100.5%, Spectrum™ Chemical