4-Amino-8-chloro-6-methylquinoline - CAS 948293-57-0

Catalog:	BB041545
Product Name:	4-Amino-8-chloro-6-methylquinoline
CAS:	948293-57-0
Synonyms:	8-chloro-6-methylquinolin-4-amine

Technical Data

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Computed Properties

IUPAC Name:	8-chloro-6-methylquinolin-4-amine
Description:	4-Amino-8-chloro-6-methylquinoline (CAS# 948293-57-0) is a useful research chemical.
Molecular Weight:	192.64
Molecular Formula:	C10H9ClN2
Canonical SMILES:	CC1=CC2=C(C=CN=C2C(=C1)Cl)N
InChI:	InChI=1S/C10H9ClN2/c1-6-4-7-9(12)2-3-13-10(7)8(11)5-6/h2-5H,1H3,(H2,12,13)
InChI Key:	AACXNUWLLIDMPR-UHFFFAOYSA-N
Boiling Point:	382 °C at 760 mmHg
Density:	1.307 g/cm³
LogP:	3.36000

Publication Number	Title	Priority Date
AU-2011351375-A1	Heterocyclic compounds and their use as glycogen synthase kinase-3 inhibitors	20101230
AU-2011351375-B2	Heterocyclic compounds and their use as glycogen synthase kinase-3 inhibitors	20101230
CA-2821863-A1	Heterocyclic compounds and their use as glycogen synthase kinase-3 inhibitors	20101230
CN-103476766-B	Heterocyclic compound and they are as the purposes of glycogen synthase kinase-3 inhibitors	20101230
EP-2658854-A2	Heterocyclic compounds and their use as glycogen synthase kinase-3 inhibitors	20101230

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GHS Hazard Statement:	H302 (100%): Harmful if swallowed [Warning Acute toxicity, oral]; H318 (100%): Causes serious eye damage [Danger Serious eye damage/eye irritation]
Precautionary Statement:	P264, P264+P265, P270, P280, P301+P317, P305+P354+P338, P317, P330, and P501
Signal Word:	Danger

Complexity:	186
Compound Is Canonicalized:	Yes
Covalently-Bonded Unit Count:	1
Defined Atom Stereocenter Count:	0
Defined Bond Stereocenter Count:	0
Exact Mass:	192.045426
Formal Charge:	0
Heavy Atom Count:	13
Hydrogen Bond Acceptor Count:	2
Hydrogen Bond Donor Count:	1
Isotope Atom Count:	0
Monoisotopic Mass:	192.045426
Rotatable Bond Count:	0
Topological Polar Surface Area:	38.9
Undefined Atom Stereocenter Count:	0
Undefined Bond Stereocenter Count:	0
XLogP3:	2.5