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 (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+]

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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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Methyl 3-chloro-5-iodobenzoate, 98%, Thermo Scientific Chemicals

CAS: 289039-85-6 Molecular Formula: C8H6ClIO2 Molecular Weight (g/mol): 296.488 MDL Number: MFCD00673018 InChI Key: ZDSIXLJPASGHDW-UHFFFAOYSA-N Synonym: acmc-20akhf,methyl 5-chloro-3-iodobenzoate,3-chloro-5-iodo-benzoic acid methyl ester,3-chloro-5-iodobenzoic acid methyl ester PubChem CID: 24721134 IUPAC Name: methyl 3-chloro-5-iodobenzoate SMILES: COC(=O)C1=CC(=CC(=C1)I)Cl

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Specifications

PubChem CID	24721134
CAS	289039-85-6
Molecular Weight (g/mol)	296.488
MDL Number	MFCD00673018
SMILES	COC(=O)C1=CC(=CC(=C1)I)Cl
Synonym	acmc-20akhf,methyl 5-chloro-3-iodobenzoate,3-chloro-5-iodo-benzoic acid methyl ester,3-chloro-5-iodobenzoic acid methyl ester
IUPAC Name	methyl 3-chloro-5-iodobenzoate
InChI Key	ZDSIXLJPASGHDW-UHFFFAOYSA-N
Molecular Formula	C8H6ClIO2

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4-Chloro-2-methylbenzoic acid, 98%

CAS: 7499-07-2 Molecular Formula: C8H7ClO2 Molecular Weight (g/mol): 170.59 MDL Number: MFCD00045852

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Specifications

CAS	7499-07-2
Molecular Weight (g/mol)	170.59
MDL Number	MFCD00045852
Molecular Formula	C8H7ClO2

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Ethyl pentafluorobenzoate, 98%

CAS: 4522-93-4 Molecular Formula: C9H5F5O2 Molecular Weight (g/mol): 240.13 MDL Number: MFCD00039211 InChI Key: DFUDMSIRGGTHGI-UHFFFAOYSA-N Synonym: ethyl pentafluorobenzoate,ethyl perfluorobenzoate,pentafluorobenzoic acid ethyl ester,2,3,4,5,6-pentafluoro-benzoic acid ethyl ester,benzoic acid, pentafluoro-, ethyl ester,ethylpentafluorobenzoate,acmc-1ajj1,rarechem al bi 0017,perfluorobenzoic acid ethyl ester PubChem CID: 78283 IUPAC Name: ethyl 2,3,4,5,6-pentafluorobenzoate SMILES: CCOC(=O)C1=C(F)C(F)=C(F)C(F)=C1F

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Specifications

PubChem CID	78283
CAS	4522-93-4
Molecular Weight (g/mol)	240.13
MDL Number	MFCD00039211
SMILES	CCOC(=O)C1=C(F)C(F)=C(F)C(F)=C1F
Synonym	ethyl pentafluorobenzoate,ethyl perfluorobenzoate,pentafluorobenzoic acid ethyl ester,2,3,4,5,6-pentafluoro-benzoic acid ethyl ester,benzoic acid, pentafluoro-, ethyl ester,ethylpentafluorobenzoate,acmc-1ajj1,rarechem al bi 0017,perfluorobenzoic acid ethyl ester
IUPAC Name	ethyl 2,3,4,5,6-pentafluorobenzoate
InChI Key	DFUDMSIRGGTHGI-UHFFFAOYSA-N
Molecular Formula	C9H5F5O2

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4-Chlorobenzoyl chloride, 99+%

CAS: 122-01-0 Molecular Formula: C₇H₄Cl₂O Molecular Weight (g/mol): 175.01 InChI Key: RKIDDEGICSMIJA-UHFFFAOYSA-N Synonym: benzoyl chloride, 4-chloro,p-chlorobenzoyl chloride,para-chlorobenzoyl chloride,4-chlorobenzoic acid chloride,4-chlorobenzoylchloride,4-chloro benzoyl chloride,benzoylchloride, 4-chloro,benzoyl chloride, p-chloro,ccris 8935,pcboc PubChem CID: 8501 ChEBI: CHEBI:60716 IUPAC Name: 4-chlorobenzoyl chloride SMILES: C1=CC(=CC=C1C(=O)Cl)Cl

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PubChem CID	8501
CAS	122-01-0
Molecular Weight (g/mol)	175.01
ChEBI	CHEBI:60716
SMILES	C1=CC(=CC=C1C(=O)Cl)Cl
Synonym	benzoyl chloride, 4-chloro,p-chlorobenzoyl chloride,para-chlorobenzoyl chloride,4-chlorobenzoic acid chloride,4-chlorobenzoylchloride,4-chloro benzoyl chloride,benzoylchloride, 4-chloro,benzoyl chloride, p-chloro,ccris 8935,pcboc
IUPAC Name	4-chlorobenzoyl chloride
InChI Key	RKIDDEGICSMIJA-UHFFFAOYSA-N
Molecular Formula	C₇H₄Cl₂O

3-Chlorobenzoyl chloride, 99+%

CAS: 618-46-2 Molecular Formula: C7H4Cl2O Molecular Weight (g/mol): 175.01 MDL Number: MFCD00000671 InChI Key: WHIHIKVIWVIIER-UHFFFAOYSA-N Synonym: m-chlorobenzoyl chloride,benzoyl chloride, 3-chloro,benzoyl chloride, m-chloro,m-chlorobenzoylchloride,3-chlorobenzoylchloride,benzoylchloride, 3-chloro,mcoc,3-chlorobenzoic acid chloride,ccris 8615,3chlorobenzoyl chloride PubChem CID: 69252 IUPAC Name: 3-chlorobenzoyl chloride SMILES: ClC(=O)C1=CC=CC(Cl)=C1

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Specifications

PubChem CID	69252
CAS	618-46-2
Molecular Weight (g/mol)	175.01
MDL Number	MFCD00000671
SMILES	ClC(=O)C1=CC=CC(Cl)=C1
Synonym	m-chlorobenzoyl chloride,benzoyl chloride, 3-chloro,benzoyl chloride, m-chloro,m-chlorobenzoylchloride,3-chlorobenzoylchloride,benzoylchloride, 3-chloro,mcoc,3-chlorobenzoic acid chloride,ccris 8615,3chlorobenzoyl chloride
IUPAC Name	3-chlorobenzoyl chloride
InChI Key	WHIHIKVIWVIIER-UHFFFAOYSA-N
Molecular Formula	C7H4Cl2O

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Methyl 4-bromobenzoate, 98+%

CAS: 619-42-1 Molecular Formula: C8H7BrO2 Molecular Weight (g/mol): 215.046 MDL Number: MFCD00013531 InChI Key: CZNGTXVOZOWWKM-UHFFFAOYSA-N Synonym: benzoic acid, 4-bromo-, methyl ester,methyl p-bromobenzoate,4-bromobenzoic acid methyl ester,p-bromobenzoic acid, methyl ester,unii-ub1ysj5xar,ub1ysj5xar,benzoic acid, p-bromo-, methyl ester,pubchem3962,methyl-4-bromobenzoate,methyl p-bromo benzoate PubChem CID: 12081 IUPAC Name: methyl 4-bromobenzoate SMILES: COC(=O)C1=CC=C(C=C1)Br

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Specifications

PubChem CID	12081
CAS	619-42-1
Molecular Weight (g/mol)	215.046
MDL Number	MFCD00013531
SMILES	COC(=O)C1=CC=C(C=C1)Br
Synonym	benzoic acid, 4-bromo-, methyl ester,methyl p-bromobenzoate,4-bromobenzoic acid methyl ester,p-bromobenzoic acid, methyl ester,unii-ub1ysj5xar,ub1ysj5xar,benzoic acid, p-bromo-, methyl ester,pubchem3962,methyl-4-bromobenzoate,methyl p-bromo benzoate
IUPAC Name	methyl 4-bromobenzoate
InChI Key	CZNGTXVOZOWWKM-UHFFFAOYSA-N
Molecular Formula	C8H7BrO2

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Methyl 3-chlorobenzoate, 98%

CAS: 2905-65-9 Molecular Formula: C8H7ClO2 Molecular Weight (g/mol): 170.59 MDL Number: MFCD00000592 InChI Key: XRDRKVPNHIWTBX-UHFFFAOYSA-N Synonym: methyl m-chlorobenzoate,benzoic acid, 3-chloro-, methyl ester,m-chlorobenzoic acid methyl ester,methyl-3-chlorobenzoate,benzoic acid, m-chloro-, methyl ester,3-chlorobenzoic acid methyl ester,3-chloro-benzoic acid methyl ester,acmc-1cegg,dsstox_cid_7507,3-chlorobenzoic acid methyl PubChem CID: 17946 IUPAC Name: methyl 3-chlorobenzoate SMILES: COC(=O)C1=CC=CC(Cl)=C1

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Specifications

PubChem CID	17946
CAS	2905-65-9
Molecular Weight (g/mol)	170.59
MDL Number	MFCD00000592
SMILES	COC(=O)C1=CC=CC(Cl)=C1
Synonym	methyl m-chlorobenzoate,benzoic acid, 3-chloro-, methyl ester,m-chlorobenzoic acid methyl ester,methyl-3-chlorobenzoate,benzoic acid, m-chloro-, methyl ester,3-chlorobenzoic acid methyl ester,3-chloro-benzoic acid methyl ester,acmc-1cegg,dsstox_cid_7507,3-chlorobenzoic acid methyl
IUPAC Name	methyl 3-chlorobenzoate
InChI Key	XRDRKVPNHIWTBX-UHFFFAOYSA-N
Molecular Formula	C8H7ClO2

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2,5-Difluorobenzoyl chloride, 97+%

CAS: 35730-09-7 Molecular Formula: C7H3ClF2O Molecular Weight (g/mol): 176.547 MDL Number: MFCD00009929 InChI Key: RLRUKKDFNWXXRT-UHFFFAOYSA-N Synonym: 2,5-difluorobenzoylchloride,benzoyl chloride, 2,5-difluoro,benzoyl chloride,2,5-difluoro,acmc-1afez,2,5-difluoro benzoyl chloride,2,5-difluoro-benzoyl chloride,2,5-difluorobenzoyl chloride PubChem CID: 588082 IUPAC Name: 2,5-difluorobenzoyl chloride SMILES: C1=CC(=C(C=C1F)C(=O)Cl)F

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Specifications

PubChem CID	588082
CAS	35730-09-7
Molecular Weight (g/mol)	176.547
MDL Number	MFCD00009929
SMILES	C1=CC(=C(C=C1F)C(=O)Cl)F
Synonym	2,5-difluorobenzoylchloride,benzoyl chloride, 2,5-difluoro,benzoyl chloride,2,5-difluoro,acmc-1afez,2,5-difluoro benzoyl chloride,2,5-difluoro-benzoyl chloride,2,5-difluorobenzoyl chloride
IUPAC Name	2,5-difluorobenzoyl chloride
InChI Key	RLRUKKDFNWXXRT-UHFFFAOYSA-N
Molecular Formula	C7H3ClF2O

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2,4-Difluorobenzoic acid, 98%

CAS: 1583-58-0 Molecular Formula: C7H4F2O2 Molecular Weight (g/mol): 158.10 MDL Number: MFCD00011670 InChI Key: NJYBIFYEWYWYAN-UHFFFAOYSA-N Synonym: 2,4-dfba,benzoic acid, 2,4-difluoro,2,4-difluorobenzoicacid,2,4-difluoro-benzoic acid,zlchem 472,pubchem1336,acmc-1brgf,2,4-difluorbenzoic acid,2,4-difluorobezoic acid,2 4-difluorobenzoic acid PubChem CID: 74102 IUPAC Name: 2,4-difluorobenzoic acid SMILES: OC(=O)C1=CC=C(F)C=C1F

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PubChem CID	74102
CAS	1583-58-0
Molecular Weight (g/mol)	158.10
MDL Number	MFCD00011670
SMILES	OC(=O)C1=CC=C(F)C=C1F
Synonym	2,4-dfba,benzoic acid, 2,4-difluoro,2,4-difluorobenzoicacid,2,4-difluoro-benzoic acid,zlchem 472,pubchem1336,acmc-1brgf,2,4-difluorbenzoic acid,2,4-difluorobezoic acid,2 4-difluorobenzoic acid
IUPAC Name	2,4-difluorobenzoic acid
InChI Key	NJYBIFYEWYWYAN-UHFFFAOYSA-N
Molecular Formula	C7H4F2O2

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3-Ethoxy-2,4-difluorobenzoic acid, 97%

CAS: 1017779-88-2 Molecular Formula: C9H8F2O3 Molecular Weight (g/mol): 202.157 MDL Number: MFCD09258723 InChI Key: KUOUFQUWQYELBO-UHFFFAOYSA-N Synonym: 3-ethoxy-2,4-difluorobenzoic acid, jrd PubChem CID: 46737640 IUPAC Name: 3-ethoxy-2,4-difluorobenzoic acid SMILES: CCOC1=C(C=CC(=C1F)C(=O)O)F

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Specifications

PubChem CID	46737640
CAS	1017779-88-2
Molecular Weight (g/mol)	202.157
MDL Number	MFCD09258723
SMILES	CCOC1=C(C=CC(=C1F)C(=O)O)F
Synonym	3-ethoxy-2,4-difluorobenzoic acid, jrd
IUPAC Name	3-ethoxy-2,4-difluorobenzoic acid
InChI Key	KUOUFQUWQYELBO-UHFFFAOYSA-N
Molecular Formula	C9H8F2O3

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5-Bromo-2-methylbenzoic acid, 97%, Thermo Scientific Chemicals

CAS: 79669-49-1 Molecular Formula: C8H7BrO2 Molecular Weight (g/mol): 215.05 MDL Number: MFCD00267350 InChI Key: SEENCYZQHCUTSB-UHFFFAOYSA-N Synonym: 2-methyl-5-bromobenzoic acid,5-bromo-o-toluic acid,5-bromo-2-methyl-benzoic acid,5-bromo-2-methyl benzoic acid,synquest 2721-9-x8,benzoic acid, 5-bromo-2-methyl,pubchem4728,acmc-1bhwo,3-bromo-6-methylbenzoic acid,ksc497q7f PubChem CID: 346004 IUPAC Name: 5-bromo-2-methylbenzoic acid SMILES: CC1=CC=C(Br)C=C1C(O)=O

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Specifications

PubChem CID	346004
CAS	79669-49-1
Molecular Weight (g/mol)	215.05
MDL Number	MFCD00267350
SMILES	CC1=CC=C(Br)C=C1C(O)=O
Synonym	2-methyl-5-bromobenzoic acid,5-bromo-o-toluic acid,5-bromo-2-methyl-benzoic acid,5-bromo-2-methyl benzoic acid,synquest 2721-9-x8,benzoic acid, 5-bromo-2-methyl,pubchem4728,acmc-1bhwo,3-bromo-6-methylbenzoic acid,ksc497q7f
IUPAC Name	5-bromo-2-methylbenzoic acid
InChI Key	SEENCYZQHCUTSB-UHFFFAOYSA-N
Molecular Formula	C8H7BrO2

Sodium 4-aminosalicylate dihydrate, 98%

CAS: 6018-19-5 Molecular Formula: C7H10NNaO5 Molecular Weight (g/mol): 211.149 MDL Number: MFCD00151044 InChI Key: GMUQJDAYXZXBOT-UHFFFAOYSA-M Synonym: sodium 4-aminosalicylate dihydrate,sodium 4-amino-2-hydroxybenzoate dihydrate,parasal sodium,4-aminosalicylic acid sodium salt dihydrate,unii-s38b9w6axw,aminosalicylate sodium,sodium aminosalicylate,sodium p.a.s.,s38b9w6axw,aminosalicylate sodium usp PubChem CID: 16211148 IUPAC Name: sodium;4-amino-2-hydroxybenzoate;dihydrate SMILES: C1=CC(=C(C=C1N)O)C(=O)[O-].O.O.[Na+]

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Specifications

PubChem CID	16211148
CAS	6018-19-5
Molecular Weight (g/mol)	211.149
MDL Number	MFCD00151044
SMILES	C1=CC(=C(C=C1N)O)C(=O)[O-].O.O.[Na+]
Synonym	sodium 4-aminosalicylate dihydrate,sodium 4-amino-2-hydroxybenzoate dihydrate,parasal sodium,4-aminosalicylic acid sodium salt dihydrate,unii-s38b9w6axw,aminosalicylate sodium,sodium aminosalicylate,sodium p.a.s.,s38b9w6axw,aminosalicylate sodium usp
IUPAC Name	sodium;4-amino-2-hydroxybenzoate;dihydrate
InChI Key	GMUQJDAYXZXBOT-UHFFFAOYSA-M
Molecular Formula	C7H10NNaO5

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3,5-Dibromosalicylic acid, 97%, Thermo Scientific™

CAS: 3147-55-5 Molecular Formula: C₇H₄Br₂O₃ Molecular Weight (g/mol): 295.9 InChI Key: BFBZHSOXKROMBG-UHFFFAOYSA-N Synonym: 3,5-dibromosalicylic acid,benzoic acid, 3,5-dibromo-2-hydroxy,2-hydroxy-3,5-dibromobenzoic acid,unii-t5jo5ua21h,salicylic acid, 3,5-dibromo,t5jo5ua21h,rarechem al bo 2002,attercop-chm at113669,labotest-bb lt00455167,labotest-bb lt03333482 PubChem CID: 18464 IUPAC Name: 3,5-dibromo-2-hydroxybenzoic acid SMILES: C1=C(C=C(C(=C1Br)O)C(=O)O)Br

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Specifications

PubChem CID	18464
CAS	3147-55-5
Molecular Weight (g/mol)	295.9
SMILES	C1=C(C=C(C(=C1Br)O)C(=O)O)Br
Synonym	3,5-dibromosalicylic acid,benzoic acid, 3,5-dibromo-2-hydroxy,2-hydroxy-3,5-dibromobenzoic acid,unii-t5jo5ua21h,salicylic acid, 3,5-dibromo,t5jo5ua21h,rarechem al bo 2002,attercop-chm at113669,labotest-bb lt00455167,labotest-bb lt03333482
IUPAC Name	3,5-dibromo-2-hydroxybenzoic acid
InChI Key	BFBZHSOXKROMBG-UHFFFAOYSA-N
Molecular Formula	C₇H₄Br₂O₃

Hydroxybenzoic Acid Derivatives

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