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Hydroxybenzoic Acid Derivatives

Organic compounds that are directly derived from hydroxybenzoic acid; hydroxybenzoic acid consists of benzoic acid with a hydroxyl group substitution.
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Sodium Salicylate (Small Crystals, Free Flowing/USP), Fisher Chemical™

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+]

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
2
Promotions Available

Sodium Salicylate (Powder/Certified), Fisher Chemical

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+]

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
3

3-Bromo-2,6-dimethoxybenzoic acid, ≥97%, Thermo Scientific™

CAS: 73219-89-3 Molecular Formula: C9H9BrO4 Molecular Weight (g/mol): 261.071 MDL Number: MFCD00052933 InChI Key: CUQANLQRQJHIQE-UHFFFAOYSA-N PubChem CID: 2774744 IUPAC Name: 3-bromo-2,6-dimethoxybenzoic acid SMILES: COC1=C(C(=C(C=C1)Br)OC)C(=O)O

PubChem CID 2774744
CAS 73219-89-3
Molecular Weight (g/mol) 261.071
MDL Number MFCD00052933
SMILES COC1=C(C(=C(C=C1)Br)OC)C(=O)O
IUPAC Name 3-bromo-2,6-dimethoxybenzoic acid
InChI Key CUQANLQRQJHIQE-UHFFFAOYSA-N
Molecular Formula C9H9BrO4
4

Oxyclozanide, British Pharmacopoeia (BP) Reference Standard, MilliporeSigma™ Supelco™

This product is provided as delivered and specified by the issuing Pharmacopoeia. All information provided in support of this product, including SDS and any product information leaflets, has been developed and issued under the Authority of the issuing Pharmacopoeia.

5

N-P-Chlorobenzoyltyramine, British Pharmacopoeia (BP) Reference Standard, MilliporeSigma™ Supelco™

This product is provided as delivered and specified by the issuing Pharmacopoeia. All information provided in support of this product, including SDS and any product information leaflets, has been developed and issued under the Authority of the issuing Pharmacopoeia.

6

O-Acetylsalicylic acid, 99%

CAS: 50-78-2 Molecular Formula: C9H8O4 Molecular Weight (g/mol): 180.16 MDL Number: MFCD00002430 InChI Key: BSYNRYMUTXBXSQ-UHFFFAOYSA-N Synonym: aspirin,acetylsalicylic acid,2-acetoxybenzoic acid,2-acetyloxy benzoic acid,acetylsalicylate,o-acetylsalicylic acid,o-acetoxybenzoic acid,acylpyrin,polopiryna,easprin PubChem CID: 2244 ChEBI: CHEBI:15365 IUPAC Name: 2-acetyloxybenzoic acid SMILES: CC(=O)OC1=CC=CC=C1C(O)=O

PubChem CID 2244
CAS 50-78-2
Molecular Weight (g/mol) 180.16
ChEBI CHEBI:15365
MDL Number MFCD00002430
SMILES CC(=O)OC1=CC=CC=C1C(O)=O
Synonym aspirin,acetylsalicylic acid,2-acetoxybenzoic acid,2-acetyloxy benzoic acid,acetylsalicylate,o-acetylsalicylic acid,o-acetoxybenzoic acid,acylpyrin,polopiryna,easprin
IUPAC Name 2-acetyloxybenzoic acid
InChI Key BSYNRYMUTXBXSQ-UHFFFAOYSA-N
Molecular Formula C9H8O4
7

3-Chloroperoxybenzoic Acid, 70-75%, balance 3-Chlorobenzoic Acid and water

3-Chloroperoxybenzoic acid, 70-75%, C7H5ClO3, CAS Number-937-14-4, 535-80-8, 7732-18-5 | CAS: 937-14-4 | C7H5ClO3 | 172.56 g/mol

Linear Formula ClC6H4CO3H
Molecular Weight (g/mol) 172.56
ChEBI CHEBI:52091
CAS Min % 25.0
InChI Key NHQDETIJWKXCTC-UHFFFAOYSA-N
Density 0.5600g/mL
PubChem CID 70297
Name Note 70 - 75%
Percent Purity 70-75%
Fieser 01,135; 02,68; 03,49; 04,85; 05,120; 06,110; 07,62; 08,97; 09,108; 10,92; 11,122; 12,118; 13,76; 15,86; 16,80; 17,76
RTECS Number SD9470000
Formula Weight 172.57
Melting Point 92.0°C to 94.0°C
CAS Max % 30.0
Color White
Physical Form Moist Powder
SMILES OOC(=O)C1=CC=CC(Cl)=C1
Merck Index 15,2154
Assay Percent Range di-m-Chlorobenzoyl peroxide: < 0.1% Typical (HPLC)
CAS 7732-18-5
Health Hazard 3 GHS P Statement
Wear protective gloves/protective clothing/eye protection/face protection.
Keep away from heat/sparks/open flames/hot surfaces.
- No smoking.
Keep/Store away from clothing/ combustible materials.
IF SWALLOWED: rin
MDL Number MFCD00002127
Health Hazard 2 GHS H Statement
Causes severe skin burns and eye damage.
Harmful if swallowed.
Heating may cause a fire.
Solubility Information Solubility in water: insoluble. Other solubilities: soluble in koh, soluble in chloroform and acetone
Health Hazard 1 GHS Signal Word: Danger
Synonym 3-chloroperoxybenzoic acid,3-chloroperbenzoic acid,mcpba,m-chloroperbenzoic acid,m-chloroperoxybenzoic acid,meta-chloroperoxybenzoic acid,benzenecarboperoxoic acid, 3-chloro,m-chlorobenzoyl hydroperoxide,meta-chloroperbenzoic acid,3-chlorobenzoperoxoic acid
TSCA TSCA
IUPAC Name 3-chlorobenzenecarboperoxoic acid
Beilstein 09,IV,972
Molecular Formula C7H5ClO3
EINECS Number 213-322-3
Specific Gravity 0.56
8

Methyl 4-amino-3-chlorobenzoate, 97%, Thermo Scientific Chemicals

CAS: 84228-44-4 Molecular Formula: C8H8ClNO2 Molecular Weight (g/mol): 185.61 MDL Number: MFCD01320686 InChI Key: WKVJBYKFGNVWLM-UHFFFAOYSA-N Synonym: 4-amino-3-chlorobenzoic acid methyl ester,4-amino-3-chloro-benzoic acid methyl ester,methyl 4-amino-3-chloro-benzoate,benzoic acid, 4-amino-3-chloro-, methyl ester,2-chloro-4-methoxycarbonyl aniline,pubchem10804,akos bb-3098,timtec-bb sbb003712,acmc-20a51m,methyl-4-amino-3-chlorobenzoate PubChem CID: 1515284 IUPAC Name: methyl 4-amino-3-chlorobenzoate SMILES: COC(=O)C1=CC(=C(C=C1)N)Cl

PubChem CID 1515284
CAS 84228-44-4
Molecular Weight (g/mol) 185.61
MDL Number MFCD01320686
SMILES COC(=O)C1=CC(=C(C=C1)N)Cl
Synonym 4-amino-3-chlorobenzoic acid methyl ester,4-amino-3-chloro-benzoic acid methyl ester,methyl 4-amino-3-chloro-benzoate,benzoic acid, 4-amino-3-chloro-, methyl ester,2-chloro-4-methoxycarbonyl aniline,pubchem10804,akos bb-3098,timtec-bb sbb003712,acmc-20a51m,methyl-4-amino-3-chlorobenzoate
IUPAC Name methyl 4-amino-3-chlorobenzoate
InChI Key WKVJBYKFGNVWLM-UHFFFAOYSA-N
Molecular Formula C8H8ClNO2
9

2-Chloro-4-methylsulphonylbenzoic acid, 95%, Thermo Scientific™

CAS: 53250-83-2 Molecular Formula: C8H6ClO4S Molecular Weight (g/mol): 233.64 MDL Number: MFCD00216496 InChI Key: CTTWSFIIFMWHLQ-UHFFFAOYSA-M Synonym: 2-chloro-4-methylsulfonyl benzoic acid,2-chloro-4-methylsulphonylbenzoic acid,2-chloro-4-methanesulfonylbenzoic acid,benzoic acid, 2-chloro-4-methylsulfonyl,2-chloro-4-methanesulfonyl-benzoic acid,2-chloro-4-methylsulfonyl benzoic acid dry basis,maybridge1_004133,cmba,pubchem20281,acmc-1aupa PubChem CID: 735863 IUPAC Name: 2-chloro-4-methylsulfonylbenzoic acid SMILES: CS(=O)(=O)C1=CC=C(C([O-])=O)C(Cl)=C1

PubChem CID 735863
CAS 53250-83-2
Molecular Weight (g/mol) 233.64
MDL Number MFCD00216496
SMILES CS(=O)(=O)C1=CC=C(C([O-])=O)C(Cl)=C1
Synonym 2-chloro-4-methylsulfonyl benzoic acid,2-chloro-4-methylsulphonylbenzoic acid,2-chloro-4-methanesulfonylbenzoic acid,benzoic acid, 2-chloro-4-methylsulfonyl,2-chloro-4-methanesulfonyl-benzoic acid,2-chloro-4-methylsulfonyl benzoic acid dry basis,maybridge1_004133,cmba,pubchem20281,acmc-1aupa
IUPAC Name 2-chloro-4-methylsulfonylbenzoic acid
InChI Key CTTWSFIIFMWHLQ-UHFFFAOYSA-M
Molecular Formula C8H6ClO4S
10

4-Cyano-2-fluorobenzoic acid, 98%

CAS: 164149-28-4 Molecular Formula: C8H4FNO2 Molecular Weight (g/mol): 165.12 MDL Number: MFCD03094454 InChI Key: KEJMSTJTAWACNI-UHFFFAOYSA-N Synonym: 2-fluoro-4-cyanobenzoic acid,benzoic acid, 4-cyano-2-fluoro,4-cyano-2-fluoro-benzoic acid,4-cyano-2-fluorobenzoicacid,pubchem4603,acmc-1bzbk,intermediates-zcf02232,2-fluoro4-cyanobenzoic acid,ksc489o1d,4-carboxy-3-fluorobenzonitrile PubChem CID: 590659 IUPAC Name: 4-cyano-2-fluorobenzoic acid SMILES: OC(=O)C1=C(F)C=C(C=C1)C#N

PubChem CID 590659
CAS 164149-28-4
Molecular Weight (g/mol) 165.12
MDL Number MFCD03094454
SMILES OC(=O)C1=C(F)C=C(C=C1)C#N
Synonym 2-fluoro-4-cyanobenzoic acid,benzoic acid, 4-cyano-2-fluoro,4-cyano-2-fluoro-benzoic acid,4-cyano-2-fluorobenzoicacid,pubchem4603,acmc-1bzbk,intermediates-zcf02232,2-fluoro4-cyanobenzoic acid,ksc489o1d,4-carboxy-3-fluorobenzonitrile
IUPAC Name 4-cyano-2-fluorobenzoic acid
InChI Key KEJMSTJTAWACNI-UHFFFAOYSA-N
Molecular Formula C8H4FNO2
11

2-Chloro-4-fluorobenzoic acid, 98%

CAS: 2252-51-9 Molecular Formula: C7H4ClFO2 Molecular Weight (g/mol): 174.555 MDL Number: MFCD00010615 InChI Key: GRPWQLDSGNZEQE-UHFFFAOYSA-N Synonym: benzoic acid, 2-chloro-4-fluoro,2-chloro-4-fluoro-benzoic acid,2-chloro-4-fluor obenzoic acid,pubchem1370,acmc-209fx5,ksc207e4n,rarechem al bo 0405,2-chloro 4-fluoro benzoic acid,2-chloro-4-fluoro benzoic acid,4-fluoro-2-chloro-benzoic acid PubChem CID: 75259 IUPAC Name: 2-chloro-4-fluorobenzoic acid SMILES: C1=CC(=C(C=C1F)Cl)C(=O)O

PubChem CID 75259
CAS 2252-51-9
Molecular Weight (g/mol) 174.555
MDL Number MFCD00010615
SMILES C1=CC(=C(C=C1F)Cl)C(=O)O
Synonym benzoic acid, 2-chloro-4-fluoro,2-chloro-4-fluoro-benzoic acid,2-chloro-4-fluor obenzoic acid,pubchem1370,acmc-209fx5,ksc207e4n,rarechem al bo 0405,2-chloro 4-fluoro benzoic acid,2-chloro-4-fluoro benzoic acid,4-fluoro-2-chloro-benzoic acid
IUPAC Name 2-chloro-4-fluorobenzoic acid
InChI Key GRPWQLDSGNZEQE-UHFFFAOYSA-N
Molecular Formula C7H4ClFO2
12

Ethyl 4-iodobenzoate, 97%

CAS: 51934-41-9 Molecular Formula: C9H9IO2 Molecular Weight (g/mol): 276.07 MDL Number: MFCD00017344 InChI Key: YCBJOQUNPLTBGG-UHFFFAOYSA-N Synonym: p-iodobenzoic acid ethyl ester,4-iodobenzoic acid ethyl ester,ethyl p-iodobenzoate,ethyl-4-iodobenzoate,benzoicacid,4-iodo-,ethylester,4-iodo-benzoic acid ethyl ester,benzoic acid, 4-iodo-, ethyl ester,ethyl4-iodobenzoate,ethyl-4 iodobenzoate,ethyl,4-iodobenzoate PubChem CID: 142891 IUPAC Name: ethyl 4-iodobenzoate SMILES: CCOC(=O)C1=CC=C(I)C=C1

PubChem CID 142891
CAS 51934-41-9
Molecular Weight (g/mol) 276.07
MDL Number MFCD00017344
SMILES CCOC(=O)C1=CC=C(I)C=C1
Synonym p-iodobenzoic acid ethyl ester,4-iodobenzoic acid ethyl ester,ethyl p-iodobenzoate,ethyl-4-iodobenzoate,benzoicacid,4-iodo-,ethylester,4-iodo-benzoic acid ethyl ester,benzoic acid, 4-iodo-, ethyl ester,ethyl4-iodobenzoate,ethyl-4 iodobenzoate,ethyl,4-iodobenzoate
IUPAC Name ethyl 4-iodobenzoate
InChI Key YCBJOQUNPLTBGG-UHFFFAOYSA-N
Molecular Formula C9H9IO2
13

Ethyl 4-bromobenzoate, 99%

CAS: 5798-75-4 Molecular Formula: C9H9BrO2 Molecular Weight (g/mol): 229.07 MDL Number: MFCD00016329 InChI Key: XZIAFENWXIQIKR-UHFFFAOYSA-N Synonym: 4-bromobenzoic acid ethyl ester,ethyl p-bromobenzoate,benzoic acid, 4-bromo-, ethyl ester,ethyl4-bromobenzoate,ethyl-4-bromobenzoate,p-ethoxycarbonyl phenyl bromide,benzoic acid, p-bromo-, ethyl ester,4-bromo-benzoic acid ethyl ester,4-bromobenzoic acid, ethyl ester,ethyl-p-bromobenzoate PubChem CID: 22043 IUPAC Name: ethyl 4-bromobenzoate SMILES: CCOC(=O)C1=CC=C(Br)C=C1

PubChem CID 22043
CAS 5798-75-4
Molecular Weight (g/mol) 229.07
MDL Number MFCD00016329
SMILES CCOC(=O)C1=CC=C(Br)C=C1
Synonym 4-bromobenzoic acid ethyl ester,ethyl p-bromobenzoate,benzoic acid, 4-bromo-, ethyl ester,ethyl4-bromobenzoate,ethyl-4-bromobenzoate,p-ethoxycarbonyl phenyl bromide,benzoic acid, p-bromo-, ethyl ester,4-bromo-benzoic acid ethyl ester,4-bromobenzoic acid, ethyl ester,ethyl-p-bromobenzoate
IUPAC Name ethyl 4-bromobenzoate
InChI Key XZIAFENWXIQIKR-UHFFFAOYSA-N
Molecular Formula C9H9BrO2
14

4-Methylsalicylic acid, 98%

CAS: 50-85-1 MDL Number: MFCD00002454 InChI Key: NJESAXZANHETJV-UHFFFAOYSA-N Synonym: 4-methylsalicylic acid,m-cresotic acid,2,4-cresotic acid,m-cresotinic acid,2-hydroxy-p-toluic acid,m-homosalicylic acid,4-methyl-2-hydroxybenzoic acid,gamma-cresotic acid,benzoic acid, 2-hydroxy-4-methyl,4-methylsalicylate PubChem CID: 5788 ChEBI: CHEBI:20450 IUPAC Name: 2-hydroxy-4-methylbenzoic acid SMILES: CC1=CC(=C(C=C1)C(=O)O)O

PubChem CID 5788
CAS 50-85-1
ChEBI CHEBI:20450
MDL Number MFCD00002454
SMILES CC1=CC(=C(C=C1)C(=O)O)O
Synonym 4-methylsalicylic acid,m-cresotic acid,2,4-cresotic acid,m-cresotinic acid,2-hydroxy-p-toluic acid,m-homosalicylic acid,4-methyl-2-hydroxybenzoic acid,gamma-cresotic acid,benzoic acid, 2-hydroxy-4-methyl,4-methylsalicylate
IUPAC Name 2-hydroxy-4-methylbenzoic acid
InChI Key NJESAXZANHETJV-UHFFFAOYSA-N
15

Methyl 4-fluorobenzoate, 97%

CAS: 403-33-8 Molecular Formula: C8H7FO2 Molecular Weight (g/mol): 154.14 MDL Number: MFCD00017959 InChI Key: MSEBQGULDWDIRW-UHFFFAOYSA-N Synonym: methyl p-fluorobenzoate,4-fluorobenzoic acid methyl ester,methyl 4-fluorobenzoic acid,benzoic acid, 4-fluoro-, methyl ester,methyl4-fluorobenzoate,methyl-4-fluorobenzoate,4-fluoro-benzoic acid methyl ester,pubchem3566,acmc-1aef0,asischem p32019 PubChem CID: 67878 IUPAC Name: methyl 4-fluorobenzoate SMILES: COC(=O)C1=CC=C(C=C1)F

PubChem CID 67878
CAS 403-33-8
Molecular Weight (g/mol) 154.14
MDL Number MFCD00017959
SMILES COC(=O)C1=CC=C(C=C1)F
Synonym methyl p-fluorobenzoate,4-fluorobenzoic acid methyl ester,methyl 4-fluorobenzoic acid,benzoic acid, 4-fluoro-, methyl ester,methyl4-fluorobenzoate,methyl-4-fluorobenzoate,4-fluoro-benzoic acid methyl ester,pubchem3566,acmc-1aef0,asischem p32019
IUPAC Name methyl 4-fluorobenzoate
InChI Key MSEBQGULDWDIRW-UHFFFAOYSA-N
Molecular Formula C8H7FO2