4-Bromo-2-hydroxybenzoic acid - CAS 1666-28-0

Catalog:	BB012299
Product Name:	4-Bromo-2-hydroxybenzoic acid
CAS:	1666-28-0
Synonyms:	4-bromo-2-hydroxybenzoic acid

Technical Data

Safety and Hazards

Patents

Computed Properties

IUPAC Name:	4-bromo-2-hydroxybenzoic acid
Description:	4-Bromo-2-hydroxybenzoic acid (CAS# 1666-28-0) is a useful research chemical.
Molecular Weight:	217.02
Molecular Formula:	C7H5BrO3
Canonical SMILES:	C1=CC(=C(C=C1Br)O)C(=O)O
InChI:	InChI=1S/C7H5BrO3/c8-4-1-2-5(7(10)11)6(9)3-4/h1-3,9H,(H,10,11)
InChI Key:	FYAKLZKQJDBBKW-UHFFFAOYSA-N
Boiling Point:	330.2 °C
Melting Point:	164-165 °C
Purity:	98 %
Density:	1.861 g/cm³
MDL:	MFCD06797970
LogP:	1.85290

Publication Number	Title	Priority Date
WO-2021110968-A1	Macrocylces comprising a 4-amido-2,4-pentadienoate moiety for the treatment of hypoxic cancers	20191204
KR-20190126744-A	An organic electronic element using compound for organic electronic element, and an electronic device thereof	20191030
KR-102180086-B1	An organic electronic element using compound for organic electronic element, and an electronic device thereof	20191030
CN-112409223-A	Amide compounds and medical application thereof as STING inhibitor	20191012
WO-2021068950-A1	Amide compound and medical use thereof as sting inhibitor	20191012

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Related Functional Groups

Carbonyl Compounds

[17746-05-3]
Undecanoyl chloride
[1018141-88-2]
1-(2-Cyanoethyl)-3-methyl-6-phenyl-1H-pyrazolo[3,4-b]pyridine-4-carboxylic acid
[1035840-45-9]
1-(5-Methoxy-1,3-benzoxazol-2-yl)piperidine-3-carboxylic acid
[865774-78-3]
2-(6,8-difluoro-1,2,3,4-tetrahydro-naphthalen-2-ylamino)-pentanoic acid methyl ester
[1018125-51-3]
2-(6-Ethyl-3-methyl-4-(trifluoromethyl)-1H-pyrazolo[3,4-b]pyridin-1-yl)acetic acid
[17432-37-0]
2,3,5,6-Tetramethylbenzaldehyde

Oxygen Compounds

[544-62-7]
Batyl alcohol
[77987-49-6]
Z-Glycinol
[52378-69-5]
Diethyl trans-cinnamylphosphonate
[5896-75-3]
(Z)-N-(4-Phenylpiperazin-1-yl)-1-(2,3,4-trimethoxyphenyl)methanimine
[1263034-11-2]
[(2-Azido-3-hexadecoxypropoxy)-diphenylmethyl]benzene
[1281984-38-0]
1-Cyclopentyl-3,5-dinitro-1H-pyrazole

GHS Hazard Statement:	H301 (61.54%): Toxic if swallowed [Danger Acute toxicity, oral]
Precautionary Statement:	P261, P264, P270, P271, P280, P301+P310, P302+P352, P304+P340, P305+P351+P338, P312, P321, P330, P332+P313, P337+P313, P362, P403+P233, P405, and P501
Signal Word:	Danger

Complexity:	160
Compound Is Canonicalized:	Yes
Covalently-Bonded Unit Count:	1
Defined Atom Stereocenter Count:	0
Defined Bond Stereocenter Count:	0
Exact Mass:	215.94221
Formal Charge:	0
Heavy Atom Count:	11
Hydrogen Bond Acceptor Count:	3
Hydrogen Bond Donor Count:	2
Isotope Atom Count:	0
Monoisotopic Mass:	215.94221
Rotatable Bond Count:	1
Topological Polar Surface Area:	57.5 Å²
Undefined Atom Stereocenter Count:	0
Undefined Bond Stereocenter Count:	0
XLogP3:	3.2