2-Amino-4-chlorobenzamide - CAS 5900-59-4

Catalog:	BB030229
Product Name:	2-Amino-4-chlorobenzamide
CAS:	5900-59-4
Synonyms:	2-amino-4-chlorobenzamide; 2-amino-4-chlorobenzamide

Technical Data

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Computed Properties

IUPAC Name:	2-amino-4-chlorobenzamide
Description:	2-Amino-4-chlorobenzamide (CAS# 5900-59-4) is a useful research chemical.
Molecular Weight:	170.60
Molecular Formula:	C7H7ClN2O
Canonical SMILES:	C1=CC(=C(C=C1Cl)N)C(=O)N
InChI:	InChI=1S/C7H7ClN2O/c8-4-1-2-5(7(10)11)6(9)3-4/h1-3H,9H2,(H2,10,11)
InChI Key:	QNEJYHVIYJFNHC-UHFFFAOYSA-N
Boiling Point:	308.755 °C at 760 mmHg
Density:	1.394 g/cm³
MDL:	MFCD09042792
LogP:	2.30260

Publication Number	Title	Priority Date
CN-113354592-A	2-thioquinazolinone compound and preparation method and application thereof	20210630
CN-113461617-A	Method for preparing N-heterocycle through visible light mediated dehydrogenation	20210629
WO-2021194908-A1	Modified dipeptide cleavases, uses thereof and related kits	20200324
WO-2020246487-A1	Compounds having dispiro diketopiperazine structure	20190604
US-2021214701-A1	Modified cleavases, uses thereof and related kits	20190326

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GHS Hazard Statement:	H302 (100%): Harmful if swallowed [Warning Acute toxicity, oral]
Precautionary Statement:	P261, P264, P270, P272, P280, P301+P312, P302+P352, P305+P351+P338, P321, P330, P333+P313, P337+P313, P363, 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:	170.0246905
Formal Charge:	0
Heavy Atom Count:	11
Hydrogen Bond Acceptor Count:	2
Hydrogen Bond Donor Count:	2
Isotope Atom Count:	0
Monoisotopic Mass:	170.0246905
Rotatable Bond Count:	1
Topological Polar Surface Area:	69.1 Å²
Undefined Atom Stereocenter Count:	0
Undefined Bond Stereocenter Count:	0
XLogP3:	0.9