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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4-Bromo-3-fluorobenzoic acid, 98+%, Thermo Scientific Chemicals

CAS: 153556-42-4 Molecular Formula: C7H4BrFO2 Molecular Weight (g/mol): 219.009 MDL Number: MFCD00672932 InChI Key: RMYOGXPGIDWJLU-UHFFFAOYSA-N Synonym: 3-fluoro-4-bromobenzoic acid,benzoic acid, 4-bromo-3-fluoro,3-fluoro-4-bromo benzoic acid,4-bromo-3-fluoro-benzoic acid,pubchem1316,intermediates-zcf02169,acmc-1c1h6,ksc497g7p,4-bromo-3-fluoro benzoic acid PubChem CID: 2773341 IUPAC Name: 4-bromo-3-fluorobenzoic acid SMILES: C1=CC(=C(C=C1C(=O)O)F)Br

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Specifications

PubChem CID	2773341
CAS	153556-42-4
Molecular Weight (g/mol)	219.009
MDL Number	MFCD00672932
SMILES	C1=CC(=C(C=C1C(=O)O)F)Br
Synonym	3-fluoro-4-bromobenzoic acid,benzoic acid, 4-bromo-3-fluoro,3-fluoro-4-bromo benzoic acid,4-bromo-3-fluoro-benzoic acid,pubchem1316,intermediates-zcf02169,acmc-1c1h6,ksc497g7p,4-bromo-3-fluoro benzoic acid
IUPAC Name	4-bromo-3-fluorobenzoic acid
InChI Key	RMYOGXPGIDWJLU-UHFFFAOYSA-N
Molecular Formula	C7H4BrFO2

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2-Chlorobenzoic acid, 98+%

CAS: 118-91-2 Molecular Formula: C7H5ClO2 Molecular Weight (g/mol): 156.565 MDL Number: MFCD00002412 InChI Key: IKCLCGXPQILATA-UHFFFAOYSA-N Synonym: o-chlorobenzoic acid,benzoic acid, o-chloro,benzoic acid, 2-chloro,2-cba,kyselina o-chlorbenzoova,chlorobenzoic acid,ocba,benzoic acid, chloro,2-chloro-benzoic acid,chlorobenzoate PubChem CID: 8374 ChEBI: CHEBI:30793 IUPAC Name: 2-chlorobenzoic acid SMILES: C1=CC=C(C(=C1)C(=O)O)Cl

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Specifications

PubChem CID	8374
CAS	118-91-2
Molecular Weight (g/mol)	156.565
ChEBI	CHEBI:30793
MDL Number	MFCD00002412
SMILES	C1=CC=C(C(=C1)C(=O)O)Cl
Synonym	o-chlorobenzoic acid,benzoic acid, o-chloro,benzoic acid, 2-chloro,2-cba,kyselina o-chlorbenzoova,chlorobenzoic acid,ocba,benzoic acid, chloro,2-chloro-benzoic acid,chlorobenzoate
IUPAC Name	2-chlorobenzoic acid
InChI Key	IKCLCGXPQILATA-UHFFFAOYSA-N
Molecular Formula	C7H5ClO2

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Pentafluorobenzoic acid, 98+%

CAS: 602-94-8 Molecular Formula: C7HF5O2 Molecular Weight (g/mol): 212.08 MDL Number: MFCD00002406 InChI Key: YZERDTREOUSUHF-UHFFFAOYSA-N Synonym: pentafluorobenzoic acid,perfluorobenzoic acid,benzoic acid, pentafluoro,benzoic acid, 2,3,4,5,6-pentafluoro,2,3,4,5,6-pentafluorobenzoicacid,pubchem2320,acmc-1b1wz,4-09-00-00956 beilstein handbook reference,ksc355e3b,rarechem al bo 0017 PubChem CID: 11770 ChEBI: CHEBI:46796 IUPAC Name: 2,3,4,5,6-pentafluorobenzoic acid SMILES: OC(=O)C1=C(F)C(F)=C(F)C(F)=C1F

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Specifications

PubChem CID	11770
CAS	602-94-8
Molecular Weight (g/mol)	212.08
ChEBI	CHEBI:46796
MDL Number	MFCD00002406
SMILES	OC(=O)C1=C(F)C(F)=C(F)C(F)=C1F
Synonym	pentafluorobenzoic acid,perfluorobenzoic acid,benzoic acid, pentafluoro,benzoic acid, 2,3,4,5,6-pentafluoro,2,3,4,5,6-pentafluorobenzoicacid,pubchem2320,acmc-1b1wz,4-09-00-00956 beilstein handbook reference,ksc355e3b,rarechem al bo 0017
IUPAC Name	2,3,4,5,6-pentafluorobenzoic acid
InChI Key	YZERDTREOUSUHF-UHFFFAOYSA-N
Molecular Formula	C7HF5O2

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3-Aminosalicylic acid, 97%

CAS: 570-23-0 Molecular Formula: C₇H₇NO₃ Molecular Weight (g/mol): 153.14 MDL Number: MFCD00010299 InChI Key: IQGMRVWUTCYCST-UHFFFAOYSA-N Synonym: 3-aminosalicylic acid,3-amino salicylic acid,benzoic acid, 3-amino-2-hydroxy,3-amino-2-hydroxy-benzoic acid,2-amino-6-carboxyphenol,salicylic acid, 3-amino,3-carboxy-2-hydroxyaniline,3 or 5-aminosalicylic acid,benzoic acid, amino-2-hydroxy PubChem CID: 68443 IUPAC Name: 3-amino-2-hydroxybenzoic acid SMILES: C1=CC(=C(C(=C1)N)O)C(=O)O

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Specifications

PubChem CID	68443
CAS	570-23-0
Molecular Weight (g/mol)	153.14
MDL Number	MFCD00010299
SMILES	C1=CC(=C(C(=C1)N)O)C(=O)O
Synonym	3-aminosalicylic acid,3-amino salicylic acid,benzoic acid, 3-amino-2-hydroxy,3-amino-2-hydroxy-benzoic acid,2-amino-6-carboxyphenol,salicylic acid, 3-amino,3-carboxy-2-hydroxyaniline,3 or 5-aminosalicylic acid,benzoic acid, amino-2-hydroxy
IUPAC Name	3-amino-2-hydroxybenzoic acid
InChI Key	IQGMRVWUTCYCST-UHFFFAOYSA-N
Molecular Formula	C₇H₇NO₃

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3-Bromobenzoic acid, 98+%

CAS: 585-76-2 Molecular Formula: C7H5BrO2 Molecular Weight (g/mol): 201.019 MDL Number: MFCD00002487 InChI Key: VOIZNVUXCQLQHS-UHFFFAOYSA-N Synonym: m-bromobenzoic acid,3-brombenzoic acid,benzoic acid, 3-bromo,3-bromo-benzoic acid,benzoic acid, m-bromo,unii-7dct3a73lx,7dct3a73lx,3-bromo benzene acid,3-bromobenzoicacid,4-fluorobenzoicacid PubChem CID: 11456 IUPAC Name: 3-bromobenzoic acid SMILES: C1=CC(=CC(=C1)Br)C(=O)O

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Specifications

PubChem CID	11456
CAS	585-76-2
Molecular Weight (g/mol)	201.019
MDL Number	MFCD00002487
SMILES	C1=CC(=CC(=C1)Br)C(=O)O
Synonym	m-bromobenzoic acid,3-brombenzoic acid,benzoic acid, 3-bromo,3-bromo-benzoic acid,benzoic acid, m-bromo,unii-7dct3a73lx,7dct3a73lx,3-bromo benzene acid,3-bromobenzoicacid,4-fluorobenzoicacid
IUPAC Name	3-bromobenzoic acid
InChI Key	VOIZNVUXCQLQHS-UHFFFAOYSA-N
Molecular Formula	C7H5BrO2

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4-Fluorobenzoyl chloride, 98%

CAS: 403-43-0 Molecular Formula: C7H4ClFO Molecular Weight (g/mol): 158.556 MDL Number: MFCD00000684 InChI Key: CZKLEJHVLCMVQR-UHFFFAOYSA-N Synonym: benzoyl chloride, 4-fluoro,p-fluorobenzoyl chloride,benzoyl chloride, p-fluoro,p-fluorobenzoic acid chloride,4-fluorobenzoylchloride,fluorobenzoyl 4-chloride,4-fluorobenzoic acid chloride,p-fluorobenzoylchloride,p-fluorobenzoyl choride,4-flurobenzoyl chloride PubChem CID: 67879 IUPAC Name: 4-fluorobenzoyl chloride SMILES: C1=CC(=CC=C1C(=O)Cl)F

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Specifications

PubChem CID	67879
CAS	403-43-0
Molecular Weight (g/mol)	158.556
MDL Number	MFCD00000684
SMILES	C1=CC(=CC=C1C(=O)Cl)F
Synonym	benzoyl chloride, 4-fluoro,p-fluorobenzoyl chloride,benzoyl chloride, p-fluoro,p-fluorobenzoic acid chloride,4-fluorobenzoylchloride,fluorobenzoyl 4-chloride,4-fluorobenzoic acid chloride,p-fluorobenzoylchloride,p-fluorobenzoyl choride,4-flurobenzoyl chloride
IUPAC Name	4-fluorobenzoyl chloride
InChI Key	CZKLEJHVLCMVQR-UHFFFAOYSA-N
Molecular Formula	C7H4ClFO

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Methyl 2-amino-4-chlorobenzoate, 98%

CAS: 5900-58-3 Molecular Formula: C8H8ClNO2 Molecular Weight (g/mol): 185.607 MDL Number: MFCD00017568 InChI Key: YPSSCICDVDOEAI-UHFFFAOYSA-N Synonym: methyl 4-chloroanthranilate,2-amino-4-chloro-benzoic acid methyl ester,methyl2-amino-4-chlorobenzoate,benzoic acid, 2-amino-4-chloro-, methyl ester,2-amino-4-chlorobenzoic acid methyl ester,pubchem4643,methyl 4-chloro-anthranilate,methyl 2-amino4-chlorobenzoate,methyl-2-amino-4-chlorobenzoate PubChem CID: 80001 IUPAC Name: methyl 2-amino-4-chlorobenzoate SMILES: COC(=O)C1=C(C=C(C=C1)Cl)N

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Specifications

PubChem CID	80001
CAS	5900-58-3
Molecular Weight (g/mol)	185.607
MDL Number	MFCD00017568
SMILES	COC(=O)C1=C(C=C(C=C1)Cl)N
Synonym	methyl 4-chloroanthranilate,2-amino-4-chloro-benzoic acid methyl ester,methyl2-amino-4-chlorobenzoate,benzoic acid, 2-amino-4-chloro-, methyl ester,2-amino-4-chlorobenzoic acid methyl ester,pubchem4643,methyl 4-chloro-anthranilate,methyl 2-amino4-chlorobenzoate,methyl-2-amino-4-chlorobenzoate
IUPAC Name	methyl 2-amino-4-chlorobenzoate
InChI Key	YPSSCICDVDOEAI-UHFFFAOYSA-N
Molecular Formula	C8H8ClNO2

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Methyl 2-amino-5-bromobenzoate, 98%

CAS: 52727-57-8 Molecular Formula: C8H8BrNO2 Molecular Weight (g/mol): 230.06 MDL Number: MFCD00144761 InChI Key: QVNYNHCNNGKULA-UHFFFAOYSA-N Synonym: methyl 5-bromoanthranilate,2-amino-5-bromobenzoic acid methyl ester,5-bromoanthranilic acid methyl ester,2-amino-5-bromo-benzoic acid methyl ester,methyl 5-bromo-2-aminobenzoate,benzoic acid, 2-amino-5-bromo-, methyl ester,benzoic acid, 2-amino-5-bromo-, methyl ester, hydrochloride,pubchem3344,methyl-5-bromoanthranilate,acmc-1ats7 PubChem CID: 736224 IUPAC Name: methyl 2-amino-5-bromobenzoate SMILES: COC(=O)C1=CC(Br)=CC=C1N

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Specifications

PubChem CID	736224
CAS	52727-57-8
Molecular Weight (g/mol)	230.06
MDL Number	MFCD00144761
SMILES	COC(=O)C1=CC(Br)=CC=C1N
Synonym	methyl 5-bromoanthranilate,2-amino-5-bromobenzoic acid methyl ester,5-bromoanthranilic acid methyl ester,2-amino-5-bromo-benzoic acid methyl ester,methyl 5-bromo-2-aminobenzoate,benzoic acid, 2-amino-5-bromo-, methyl ester,benzoic acid, 2-amino-5-bromo-, methyl ester, hydrochloride,pubchem3344,methyl-5-bromoanthranilate,acmc-1ats7
IUPAC Name	methyl 2-amino-5-bromobenzoate
InChI Key	QVNYNHCNNGKULA-UHFFFAOYSA-N
Molecular Formula	C8H8BrNO2

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3-Fluoro-4-(methoxycarbonyl)benzeneboronic acid, 97%

CAS: 505083-04-5 Molecular Formula: C8H8BFO4 Molecular Weight (g/mol): 197.956 MDL Number: MFCD04115665 InChI Key: YZYGXFXSMDUXJT-UHFFFAOYSA-N Synonym: 3-fluoro-4-methoxycarbonyl phenyl boronic acid,3-fluoro-4-methoxycarbonyl phenylboronic acid,3-fluoro-4-methoxycarbonyl benzeneboronic acid,methyl 4-borono-2-fluorobenzoate,4-methoxycarbonyl-3-fluorophenylboronic acid,pubchem17771,3-fluoro-4-methoxycarboxyphenylboronicacid,acmc-1atlt,3-fluoro-4-methoxycarbonyl-phenyl boronic acid PubChem CID: 2782818 IUPAC Name: (3-fluoro-4-methoxycarbonylphenyl)boronic acid SMILES: B(C1=CC(=C(C=C1)C(=O)OC)F)(O)O

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Specifications

PubChem CID	2782818
CAS	505083-04-5
Molecular Weight (g/mol)	197.956
MDL Number	MFCD04115665
SMILES	B(C1=CC(=C(C=C1)C(=O)OC)F)(O)O
Synonym	3-fluoro-4-methoxycarbonyl phenyl boronic acid,3-fluoro-4-methoxycarbonyl phenylboronic acid,3-fluoro-4-methoxycarbonyl benzeneboronic acid,methyl 4-borono-2-fluorobenzoate,4-methoxycarbonyl-3-fluorophenylboronic acid,pubchem17771,3-fluoro-4-methoxycarboxyphenylboronicacid,acmc-1atlt,3-fluoro-4-methoxycarbonyl-phenyl boronic acid
IUPAC Name	(3-fluoro-4-methoxycarbonylphenyl)boronic acid
InChI Key	YZYGXFXSMDUXJT-UHFFFAOYSA-N
Molecular Formula	C8H8BFO4

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3-Methylsalicylic acid, 99%

CAS: 83-40-9 Molecular Formula: C8H8O3 Molecular Weight (g/mol): 152.15 MDL Number: MFCD00002448 InChI Key: WHSXTWFYRGOBGO-UHFFFAOYSA-N Synonym: 3-methylsalicylic acid,hydroxytoluic acid,o-cresotic acid,o-cresotinic acid,cresotic acid,o-homosalicylic acid,2-hydroxy-m-toluic acid,2,3-cresotinic acid,cresotinic acid,benzoic acid, 2-hydroxy-3-methyl PubChem CID: 6738 ChEBI: CHEBI:20141 IUPAC Name: 2-hydroxy-3-methylbenzoic acid SMILES: CC1=CC=CC(C(O)=O)=C1O

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Specifications

PubChem CID	6738
CAS	83-40-9
Molecular Weight (g/mol)	152.15
ChEBI	CHEBI:20141
MDL Number	MFCD00002448
SMILES	CC1=CC=CC(C(O)=O)=C1O
Synonym	3-methylsalicylic acid,hydroxytoluic acid,o-cresotic acid,o-cresotinic acid,cresotic acid,o-homosalicylic acid,2-hydroxy-m-toluic acid,2,3-cresotinic acid,cresotinic acid,benzoic acid, 2-hydroxy-3-methyl
IUPAC Name	2-hydroxy-3-methylbenzoic acid
InChI Key	WHSXTWFYRGOBGO-UHFFFAOYSA-N
Molecular Formula	C8H8O3

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Methyl 5-chloro-2-methoxybenzoate, 98%

CAS: 33924-48-0 Molecular Formula: C9H9ClO3 Molecular Weight (g/mol): 200.618 MDL Number: MFCD00017511 InChI Key: HPTHYBXMNNGQEF-UHFFFAOYSA-N Synonym: methyl 5-chloro-o-anisate,methyl-5-chloro-2-methoxybenzoate,5-chloro-2-methoxybenzoic acid methyl ester,benzoic acid, 5-chloro-2-methoxy-, methyl ester,5-chloro-o-anisic acid methyl ester,5-chloro-2-methoxy-benzoic acid methyl ester,pubchem3709,methyl5-chloro-2-methoxybenzoate,acmc-1agpb,dsstox_cid_31509 PubChem CID: 118574 IUPAC Name: methyl 5-chloro-2-methoxybenzoate SMILES: COC1=C(C=C(C=C1)Cl)C(=O)OC

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Specifications

PubChem CID	118574
CAS	33924-48-0
Molecular Weight (g/mol)	200.618
MDL Number	MFCD00017511
SMILES	COC1=C(C=C(C=C1)Cl)C(=O)OC
Synonym	methyl 5-chloro-o-anisate,methyl-5-chloro-2-methoxybenzoate,5-chloro-2-methoxybenzoic acid methyl ester,benzoic acid, 5-chloro-2-methoxy-, methyl ester,5-chloro-o-anisic acid methyl ester,5-chloro-2-methoxy-benzoic acid methyl ester,pubchem3709,methyl5-chloro-2-methoxybenzoate,acmc-1agpb,dsstox_cid_31509
IUPAC Name	methyl 5-chloro-2-methoxybenzoate
InChI Key	HPTHYBXMNNGQEF-UHFFFAOYSA-N
Molecular Formula	C9H9ClO3

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5-Fluorosalicylic acid, 97%

CAS: 345-16-4 Molecular Formula: C7H5FO3 Molecular Weight (g/mol): 156.112 MDL Number: MFCD00002456 InChI Key: JWPRICQKUNODPZ-UHFFFAOYSA-N Synonym: 5-fluorosalicylic acid,2-hydroxy-5-fluorobenzoic acid,benzoic acid, 5-fluoro-2-hydroxy,5-fluoro-2-hydroxybenzoicacid,5-fluoro-2-hydroxy-benzoic acid,5fluorosalicylic acid,pubchem1382,5-fluoro-salicylic acid,2-carboxy-4-fluorophenol PubChem CID: 67658 IUPAC Name: 5-fluoro-2-hydroxybenzoic acid SMILES: C1=CC(=C(C=C1F)C(=O)O)O

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Specifications

PubChem CID	67658
CAS	345-16-4
Molecular Weight (g/mol)	156.112
MDL Number	MFCD00002456
SMILES	C1=CC(=C(C=C1F)C(=O)O)O
Synonym	5-fluorosalicylic acid,2-hydroxy-5-fluorobenzoic acid,benzoic acid, 5-fluoro-2-hydroxy,5-fluoro-2-hydroxybenzoicacid,5-fluoro-2-hydroxy-benzoic acid,5fluorosalicylic acid,pubchem1382,5-fluoro-salicylic acid,2-carboxy-4-fluorophenol
IUPAC Name	5-fluoro-2-hydroxybenzoic acid
InChI Key	JWPRICQKUNODPZ-UHFFFAOYSA-N
Molecular Formula	C7H5FO3

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3-Bromobenzoyl chloride, 97%

CAS: 1711-09-7 Molecular Formula: C₇H₄BrClO Molecular Weight (g/mol): 219.46 MDL Number: MFCD00000669 InChI Key: PBOOZQFGWNZNQE-UHFFFAOYSA-N Synonym: m-bromobenzoyl chloride,benzoyl chloride, 3-bromo,3-bromobenzoylchloride,benzoyl chloride, m-bromo,3-bromobenzoic acid chloride,attercop-chm at106527,3-brom-benzoylchlorid,3-bromo-benzoylchlorid,3-bromobenzoic chloride,pubchem13574 PubChem CID: 74377 IUPAC Name: 3-bromobenzoyl chloride SMILES: C1=CC(=CC(=C1)Br)C(=O)Cl

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Specifications

PubChem CID	74377
CAS	1711-09-7
Molecular Weight (g/mol)	219.46
MDL Number	MFCD00000669
SMILES	C1=CC(=CC(=C1)Br)C(=O)Cl
Synonym	m-bromobenzoyl chloride,benzoyl chloride, 3-bromo,3-bromobenzoylchloride,benzoyl chloride, m-bromo,3-bromobenzoic acid chloride,attercop-chm at106527,3-brom-benzoylchlorid,3-bromo-benzoylchlorid,3-bromobenzoic chloride,pubchem13574
IUPAC Name	3-bromobenzoyl chloride
InChI Key	PBOOZQFGWNZNQE-UHFFFAOYSA-N
Molecular Formula	C₇H₄BrClO

Hydroxybenzoic Acid Derivatives

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