4-Amino-2-bromobenzoic Acid - CAS 2486-52-4

Catalog:	BB018645
Product Name:	4-Amino-2-bromobenzoic Acid
CAS:	2486-52-4
Synonyms:	4-amino-2-bromobenzoic acid; 4-amino-2-bromobenzoic acid

Technical Data

Safety and Hazards

Patents

Computed Properties

IUPAC Name:	4-amino-2-bromobenzoic acid
Description:	4-Amino-2-bromobenzoic Acid (CAS# 2486-52-4) is a compound useful in organic synthesis.
Molecular Weight:	216.03
Molecular Formula:	C7H6BrNO2
Canonical SMILES:	C1=CC(=C(C=C1N)Br)C(=O)O
InChI:	InChI=1S/C7H6BrNO2/c8-6-3-4(9)1-2-5(6)7(10)11/h1-3H,9H2,(H,10,11)
InChI Key:	AQBXIOGPHBWBFP-UHFFFAOYSA-N
Boiling Point:	374.2 °C at 760 mmHg
Density:	1.793 g/cm³
LogP:	2.31070

Publication Number	Title	Priority Date
CN-109715728-A	Adduct and application thereof	20160819
JP-2012107008-A	Quaternary ammonium salt compounds	20101029
AU-2010242646-A1	Quaternary ammonium salt compound	20090430
CA-2760630-A1	Quaternary ammonium salt compounds	20090430
CN-102459231-A	Quaternary ammonium salt compound	20090430

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Related Functional Groups

Carbonyl Compounds

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2-Propenoic acid, 2-(3',3'-dimethyl-6-nitrospiro[2H-1-benzopyran-2,2'-[2H]indol]-1'(3'H)-yl)ethyl ester
[5650-34-0]
Oxiran-2-yl(phenyl)methanone
[51493-02-8]
N-Methyl-N-propylcarbamoyl Chloride
[1383427-98-2]
(S)-Hexahydropyrazino[2,1-c][1,4]oxazin-4(3H)-one hydrochloride
[959574-98-2]
(3-Phenyl-1H-pyrazol-1-yl)acetic acid
[70199-62-1]
(4-Pyridyl)acetone Hydrochloride

GHS Hazard Statement:	H315 (100%): Causes skin irritation [Warning Skin corrosion/irritation]; H319 (100%): Causes serious eye irritation [Warning Serious eye damage/eye irritation]; H335 (100%): May cause respiratory irritation [Warning Specific target organ toxicity, single exposure; Respiratory tract irritation]
Precautionary Statement:	P261, P264, P264+P265, P271, P280, P302+P352, P304+P340, P305+P351+P338, P319, P321, P332+P317, P337+P317, P362+P364, P403+P233, P405, and P501
Signal Word:	Warning

Complexity:	163
Compound Is Canonicalized:	Yes
Covalently-Bonded Unit Count:	1
Defined Atom Stereocenter Count:	0
Defined Bond Stereocenter Count:	0
Exact Mass:	214.95819
Formal Charge:	0
Heavy Atom Count:	11
Hydrogen Bond Acceptor Count:	3
Hydrogen Bond Donor Count:	2
Isotope Atom Count:	0
Monoisotopic Mass:	214.95819
Rotatable Bond Count:	1
Topological Polar Surface Area:	63.3
Undefined Atom Stereocenter Count:	0
Undefined Bond Stereocenter Count:	0
XLogP3:	1.8