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2-Amino-2-(4-bromophenyl)acetic acid, hydrochloride

2-Amino-2-(4-bromophenyl)acetic acid, hydrochloride - CAS 709665-71-4

Catalog:	BB075060
Product Name:	2-Amino-2-(4-bromophenyl)acetic acid, hydrochloride
CAS:	709665-71-4
Synonyms:	2-AMINO-2-(4-BROMOPHENYL)ACETIC ACID HYDROCHLORIDE; 2-Amino-2-(4-bromophenyl)acetic acid, HCl; 2-amino-2-(4-bromophenyl)acetic acid; hydrochloride; AMINO-(4-BROMO-PHENYL)-ACETIC ACID HYDROCHLORIDE

Technical Data

Safety and Hazards

Computed Properties

IUPAC Name:	2-amino-2-(4-bromophenyl)acetic acidhydrochloride
Description:	2-Amino-2-(4-bromophenyl)acetic acid, HCl
Molecular Weight:	266.52
Molecular Formula:	C8H9BrClNO2
Canonical SMILES:	C1=CC(=CC=C1C(C(=O)O)N)Br.Cl
InChI:	InChI=1S/C8H8BrNO2.ClH/c9-6-3-1-5(2-4-6)7(10)8(11)12/h1-4,7H,10H2,(H,11,12)1H
InChI Key:	WANQBUDPQVTWJW-UHFFFAOYSA-N

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GHS Hazard Statement:	H315 (100%): Causes skin irritation [Warning Skin corrosion/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:	166
Compound Is Canonicalized:	Yes
Covalently-Bonded Unit Count:	2
Defined Atom Stereocenter Count:	0
Defined Bond Stereocenter Count:	0
Exact Mass:	264.95052
Formal Charge:	0
Heavy Atom Count:	13
Hydrogen Bond Acceptor Count:	3
Hydrogen Bond Donor Count:	3
Isotope Atom Count:	0
Monoisotopic Mass:	264.95052
Rotatable Bond Count:	2
Topological Polar Surface Area:	63.3Å²
Undefined Atom Stereocenter Count:	1
Undefined Bond Stereocenter Count:	0