Benzoic acids and derivatives

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: clin PubChem CID: 16760658 ChEBI: CHEBI:9180 IUPAC Name: sodium;2-hydroxybenzoate SMILES: C1=CC=C(C(=C1)C(=O)[O-])O.[Na+]

Alfa Aesar™ 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: clin PubChem CID: 16760658 ChEBI: CHEBI:9180 IUPAC Name: sodium;2-hydroxybenzoate SMILES: C1=CC=C(C(=C1)C(=O)[O-])O.[Na+]

Salicylic Acid (Crystalline Powder/Certified ACS), Fisher Chemical

CAS: 69-72-7 Molecular Formula: C7H6O3 Molecular Weight (g/mol): 138.122 MDL Number: MFCD00002439 InChI Key: YGSDEFSMJLZEOE-UHFFFAOYSA-N Synonym: 2-carboxyphenol PubChem CID: 338 ChEBI: CHEBI:16914 IUPAC Name: 2-hydroxybenzoic acid SMILES: C1=CC=C(C(=C1)C(=O)O)O

Methyl Salicylate (Reagent), Fisher Chemical

CAS: 119-36-8 Molecular Formula: C8H8O3 Molecular Weight (g/mol): 152.149 MDL Number: MFCD00002214 InChI Key: OSWPMRLSEDHDFF-UHFFFAOYSA-N Synonym: 2-hydroxybenzoic acid methyl ester PubChem CID: 4133 ChEBI: CHEBI:31832 IUPAC Name: methyl 2-hydroxybenzoate SMILES: COC(=O)C1=CC=CC=C1O

Acetylsalicylic acid, 99%, ACROS Organics™

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

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: clin PubChem CID: 16760658 ChEBI: CHEBI:9180 IUPAC Name: sodium;2-hydroxybenzoate SMILES: C1=CC=C(C(=C1)C(=O)[O-])O.[Na+]

5,5'-Dithiobis-(2-nitrobenzoic acid), 99%, ACROS Organics™

CAS: 69-78-3 Molecular Formula: C14H8N2O8S2 Molecular Weight (g/mol): 396.34 MDL Number: MFCD00007140 InChI Key: KIUMMUBSPKGMOY-UHFFFAOYSA-N Synonym: 3,3'-dithiobis 6-nitrobenzoic acid PubChem CID: 6254 ChEBI: CHEBI:86228 SMILES: C1=CC(=C(C=C1SSC2=CC(=C(C=C2)[N+](=O)[O-])C(=O)O)C(=O)O)[N+](=O)[O-]

Gallic Acid Monohydrate (Powder/Certified) ACS, Fisher Chemical

CAS: 5995-86-8 Molecular Formula: C7H8O6 Molecular Weight (g/mol): 188.135 MDL Number: MFCD00002510 InChI Key: IUTKPPDDLYYMBE-UHFFFAOYSA-N Synonym: 3,4,5-trihydroxybenzoic acid hydrate PubChem CID: 24721416 IUPAC Name: 3,4,5-trihydroxybenzoic acid;hydrate SMILES: C1=C(C=C(C(=C1O)O)O)C(=O)O.O

2-Chlorobenzoic acid, 98%, Acros Organics

CAS: 118-91-2 Molecular Formula: C7H5ClO2 Molecular Weight (g/mol): 156.57 MDL Number: MFCD00002412 InChI Key: IKCLCGXPQILATA-UHFFFAOYSA-N Synonym: 2-cba PubChem CID: 8374 ChEBI: CHEBI:30793 IUPAC Name: 2-chlorobenzoic acid SMILES: C1=CC=C(C(=C1)C(=O)O)Cl

Methyl salicylate, 99%, ACROS Organics™

CAS: 119-36-8 Molecular Formula: C8H8O3 Molecular Weight (g/mol): 152.15 MDL Number: MFCD00002214 InChI Key: OSWPMRLSEDHDFF-UHFFFAOYSA-N Synonym: 2-hydroxybenzoic acid methyl ester PubChem CID: 4133 ChEBI: CHEBI:31832 IUPAC Name: methyl 2-hydroxybenzoate SMILES: COC(=O)C1=CC=CC=C1O

(-)-Epigallocatechin gallate, 95%, Acros Organics

CAS: 989-51-5 Molecular Formula: C22H18O11 Molecular Weight (g/mol): 458.37 MDL Number: MFCD00075940 InChI Key: WMBWREPUVVBILR-WIYYLYMNSA-N Synonym: --epigallocatechin gallate PubChem CID: 65064 ChEBI: CHEBI:4806 IUPAC Name: [(2R,3R)-5,7-dihydroxy-2-(3,4,5-trihydroxyphenyl)-3,4-dihydro-2H-chromen-3-yl] 3,4,5-trihydroxybenzoate SMILES: C1C(C(OC2=CC(=CC(=C21)O)O)C3=CC(=C(C(=C3)O)O)O)OC(=O)C4=CC(=C(C(=C4)O)O)O

Tannic acid, 95%, ACROS Organics™

CAS: 1401-55-4 Molecular Formula: C76H52O46 Molecular Weight (g/mol): 1701.206 MDL Number: MFCD00066397 InChI Key: LRBQNJMCXXYXIU-JPZKJCTESA-N Synonym: acide tannique PubChem CID: 134129492 SMILES: C1=C(C=C(C(=C1O)O)O)C(=O)OC2=CC(=CC(=C2O)O)C(=O)OCC3C(C(C(C(O3)OC(=O)C4=CC(=C(C(=C4)OC(=O)C5=CC(=C(C(=C5)O)O)O)O)O)OC(=O)C6=CC(=C(C(=C6)OC(=O)C7=CC(=C(C(=C7)O)O)O)O)O)OC(=O)C8=CC(=C(C(=C8)OC(=O)C9=CC(=C(C(=C9)O)O)O)O)O)OC(=O)C1=CC(=C(C(=C1)OC(=O)C1=CC(=C(

Nonyl 4-Hydroxybenzoate 98.0+%, TCI America™

CAS: 38713-56-3 Molecular Formula: C16H24O3 Molecular Weight (g/mol): 264.365 MDL Number: MFCD00016483 InChI Key: MBNSKHJDYXPONL-UHFFFAOYSA-N Synonym: 4-Hydroxybenzoic Acid Nonyl Ester, Nonylparaben PubChem CID: 586708 IUPAC Name: nonyl 4-hydroxybenzoate SMILES: CCCCCCCCCOC(=O)C1=CC=C(C=C1)O

Bis(2-ethylhexyl) terephthalate, 97%, Acros Organics™

CAS: 6422-86-2 Molecular Formula: C24H38O4 Molecular Weight (g/mol): 390.55 MDL Number: MFCD00072256 InChI Key: RWPICVVBGZBXNA-UHFFFAOYSA-N Synonym: 1,4-benzenedicarboxylic acid, 1,4-bis 2-ethylhexyl ester PubChem CID: 22932 IUPAC Name: bis(2-ethylhexyl) benzene-1,4-dicarboxylate SMILES: CCCCC(CC)COC(=O)C1=CC=C(C=C1)C(=O)OCC(CC)CCCC

Alfa Aesar™ Isobutyl 4-hydroxybenzoate, 98%

CAS: 4247-02-3 Molecular Formula: C11H14O3 Molecular Weight (g/mol): 194.23 MDL Number: MFCD00020167 InChI Key: XPJVKCRENWUEJH-UHFFFAOYSA-N Synonym: 4-hydroxybenzoic acid isobutyl ester PubChem CID: 20240 IUPAC Name: 2-methylpropyl 4-hydroxybenzoate SMILES: CC(C)COC(=O)C1=CC=C(C=C1)O

Tannic Acid, ACS, Alfa Aesar

CAS: 1401-55-4 Molecular Formula: C76H52O46 Molecular Weight (g/mol): 1701.206 MDL Number: MFCD00066397 InChI Key: LRBQNJMCXXYXIU-JPZKJCTESA-N Synonym: acide tannique PubChem CID: 134129492 SMILES: C1=C(C=C(C(=C1O)O)O)C(=O)OC2=CC(=CC(=C2O)O)C(=O)OCC3C(C(C(C(O3)OC(=O)C4=CC(=C(C(=C4)OC(=O)C5=CC(=C(C(=C5)O)O)O)O)O)OC(=O)C6=CC(=C(C(=C6)OC(=O)C7=CC(=C(C(=C7)O)O)O)O)O)OC(=O)C8=CC(=C(C(=C8)OC(=O)C9=CC(=C(C(=C9)O)O)O)O)O)OC(=O)C1=CC(=C(C(=C1)OC(=O)C1=CC(=C(

Salicylic acid, sodium salt, 99+%, ACROS Organics™

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

2-Aminoterephthalic acid, 99%, Acros Organics™

CAS: 10312-55-7 Molecular Formula: C8H7NO4 Molecular Weight (g/mol): 181.15 MDL Number: MFCD00134536 InChI Key: GPNNOCMCNFXRAO-UHFFFAOYSA-N Synonym: 1,4-benzenedicarboxylic acid, 2-amino PubChem CID: 2724822 IUPAC Name: 2-aminoterephthalic acid SMILES: C1=CC(=C(C=C1C(=O)O)N)C(=O)O

Alfa Aesar™ Reserpine, 99%

CAS: 50-55-5 Molecular Formula: C33H40N2O9 Molecular Weight (g/mol): 608.688 MDL Number: MFCD00005091 InChI Key: QEVHRUUCFGRFIF-MDEJGZGSSA-N Synonym: apoplon PubChem CID: 5770 ChEBI: CHEBI:28487 IUPAC Name: methyl (1R,15S,17R,18R,19S,20S)-6,18-dimethoxy-17-(3,4,5-trimethoxybenzoyl)oxy-1,3,11,12,14,15,16,17,18,19,20,21-dodecahydroyohimban-19-carboxylate SMILES: COC1C(CC2CN3CCC4=C(C3CC2C1C(=O)OC)NC5=C4C=CC(=C5)OC)OC(=O)C6=CC(=C(C(=C6)OC)OC)OC

Alfa Aesar™ Methyl salicylate, 98%

CAS: 119-36-8 Molecular Formula: C8H8O3 Molecular Weight (g/mol): 152.149 MDL Number: MFCD00002214 InChI Key: OSWPMRLSEDHDFF-UHFFFAOYSA-N Synonym: 2-hydroxybenzoic acid methyl ester PubChem CID: 4133 ChEBI: CHEBI:31832 IUPAC Name: methyl 2-hydroxybenzoate SMILES: COC(=O)C1=CC=CC=C1O

Alfa Aesar™ Isopropyl 4-hydroxybenzoate, 98%

CAS: 4191-73-5 Molecular Formula: C10H12O3 Molecular Weight (g/mol): 180.203 MDL Number: MFCD00016468 InChI Key: CMHMMKSPYOOVGI-UHFFFAOYSA-N Synonym: 4-hydroxybenzoic acid isopropyl ester PubChem CID: 20161 IUPAC Name: propan-2-yl 4-hydroxybenzoate SMILES: CC(C)OC(=O)C1=CC=C(C=C1)O

Salicylic Acid, For analysis ACS, +99%, ACROS Organics™

CAS: 69-72-7 Molecular Formula: C7H6O3 Molecular Weight (g/mol): 138.122 MDL Number: MFCD00002439 InChI Key: YGSDEFSMJLZEOE-UHFFFAOYSA-N Synonym: 2-carboxyphenol PubChem CID: 338 ChEBI: CHEBI:16914 IUPAC Name: 2-hydroxybenzoic acid SMILES: C1=CC=C(C(=C1)C(=O)O)O

Dimethyl terephthalate, 99%, ACROS Organics™

CAS: 120-61-6 Molecular Formula: C10H10O4 Molecular Weight (g/mol): 194.19 MDL Number: MFCD00008440 InChI Key: WOZVHXUHUFLZGK-UHFFFAOYSA-N Synonym: 1,4-benzenedicarboxylic acid, dimethyl ester PubChem CID: 8441 IUPAC Name: dimethyl benzene-1,4-dicarboxylate SMILES: COC(=O)C1=CC=C(C=C1)C(=O)OC

Dimethyl 5-Bromoisophthalate 98.0+%, TCI America™

CAS: 51760-21-5 Molecular Formula: C10H9BrO4 Molecular Weight (g/mol): 273.082 MDL Number: MFCD00078709 InChI Key: QUJINGKSNJNXEB-UHFFFAOYSA-N Synonym: dimethyl 5-bromoisophthalate, 5-bromoisophthalic acid dimethyl ester, dimethyl-5-bromoisophthalate, 1,3-benzenedicarboxylic acid, 5-bromo-, dimethyl ester, 1,3-dimethyl 5-bromobenzene-1,3-dicarboxylate, dimethyl5-bromoisophthalate, 5-bromo-isophthalic acid dimethyl ester, 1,3-benzenedicarboxylic acid, 5-bromo-, 1,3-dimethyl ester, methyl 5-bromo-3-methoxycarbonyl benzoate, 5-bromoisophthalic acid, dimethyl ester PubChem CID: 103954 IUPAC Name: dimethyl 5-bromobenzene-1,3-dicarboxylate SMILES: COC(=O)C1=CC(=CC(=C1)Br)C(=O)OC

Methyl Vanillate 98.0+%, TCI America™

CAS: 3943-74-6 Molecular Formula: C9H10O4 Molecular Weight (g/mol): 182.175 MDL Number: MFCD00008438 InChI Key: BVWTXUYLKBHMOX-UHFFFAOYSA-N Synonym: methyl vanillate, methyl 3-methoxy-4-hydroxybenzoate, vanillic acid, methyl ester, 4-hydroxy-3-methoxybenzoic acid methyl ester, methylvanillate, benzoic acid, 4-hydroxy-3-methoxy-, methyl ester, vanillic acid methyl ester, unii-2hxg8qso3d, 2hxg8qso3d, vxx PubChem CID: 19844 ChEBI: CHEBI:46477 IUPAC Name: methyl 4-hydroxy-3-methoxybenzoate SMILES: COC1=C(C=CC(=C1)C(=O)OC)O

4-Bromobenzoic Acid 98.0+%, TCI America™

CAS: 586-76-5 Molecular Formula: C7H5BrO2 Molecular Weight (g/mol): 201.019 MDL Number: MFCD00002529 InChI Key: TUXYZHVUPGXXQG-UHFFFAOYSA-N Synonym: 4-brom-benzoesaeure PubChem CID: 11464 ChEBI: CHEBI:60698 IUPAC Name: 4-bromobenzoic acid SMILES: C1=CC(=CC=C1C(=O)O)Br

Gallic Acid 98%, ACROS Organics™

CAS: 149-91-7 Molecular Formula: C7H6O5 Molecular Weight (g/mol): 170.12 MDL Number: MFCD00002510 InChI Key: LNTHITQWFMADLM-UHFFFAOYSA-N Synonym: 3,4,5-trihydroxybenzoate PubChem CID: 370 ChEBI: CHEBI:30778 IUPAC Name: 3,4,5-trihydroxybenzoic acid SMILES: C1=C(C=C(C(=C1O)O)O)C(=O)O

N-(3-Chlorophenyl)anthranilic Acid 98.0+%, TCI America™

CAS: 13278-36-9 Molecular Formula: C13H10ClNO2 Molecular Weight (g/mol): 247.678 MDL Number: MFCD01928172 InChI Key: OVMWPVYEBVFZHM-UHFFFAOYSA-N Synonym: 2-[(3-Chlorophenyl)amino]benzoic Acid, 2-(3-Chloroanilino)benzoic Acid PubChem CID: 83293 IUPAC Name: 2-(3-chloroanilino)benzoic acid SMILES: C1=CC=C(C(=C1)C(=O)O)NC2=CC(=CC=C2)Cl

(-)-Epigallocatechin gallate, 95%, Acros Organics™

CAS: 989-51-5 Molecular Formula: C22H18O11 Molecular Weight (g/mol): 458.37 InChI Key: WMBWREPUVVBILR-WIYYLYMNSA-N Synonym: --epigallocatechin gallate PubChem CID: 65064 ChEBI: CHEBI:4806 IUPAC Name: [(2R,3R)-5,7-dihydroxy-2-(3,4,5-trihydroxyphenyl)-3,4-dihydro-2H-chromen-3-yl] 3,4,5-trihydroxybenzoate SMILES: C1C(C(OC2=CC(=CC(=C21)O)O)C3=CC(=C(C(=C3)O)O)O)OC(=O)C4=CC(=C(C(=C4)O)O)O

Gallic acid monohydrate, ACROS Organics™

CAS: 5995-86-8 Molecular Formula: C7H8O6 Molecular Weight (g/mol): 188.135 MDL Number: MFCD00149098 InChI Key: IUTKPPDDLYYMBE-UHFFFAOYSA-N Synonym: 3,4,5-trihydroxybenzoic acid hydrate PubChem CID: 24721416 IUPAC Name: 3,4,5-trihydroxybenzoic acid;hydrate SMILES: C1=C(C=C(C(=C1O)O)O)C(=O)O.O

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