2-(2-Chloro-4-methoxyphenyl)ethanamine - CAS 67932-57-4

Catalog:	BB033440
Product Name:	2-(2-Chloro-4-methoxyphenyl)ethanamine
CAS:	67932-57-4
Synonyms:	2-(2-chloro-4-methoxyphenyl)ethanamine; 2-(2-chloro-4-methoxyphenyl)ethanamine

Technical Data

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Computed Properties

IUPAC Name:	2-(2-chloro-4-methoxyphenyl)ethanamine
Description:	2-(2-Chloro-4-methoxyphenyl)ethanamine (CAS# 67932-57-4 ) is a useful research chemical.
Molecular Weight:	185.65
Molecular Formula:	C9H12ClNO
Canonical SMILES:	COC1=CC(=C(C=C1)CCN)Cl
InChI:	InChI=1S/C9H12ClNO/c1-12-8-3-2-7(4-5-11)9(10)6-8/h2-3,6H,4-5,11H2,1H3
InChI Key:	SZQPCLQVRLLNHD-UHFFFAOYSA-N
LogP:	2.55010

Publication Number	Title	Priority Date
EP-3483149-A1	Benzo[d]thiazole derivative or salt thereof, and pharmaceutical composition including same	20160708
JP-2019520403-A	Benzo [D] thiazole derivative or salt thereof, and pharmaceutical composition containing the same	20160708
KR-20180006167-A	Benzo[d]thiazole derivative or its salt and pharmaceutical composition comprising the same	20160708
US-10383859-B2	Benzo[d]thiazole derivative or salt thereof, and pharmaceutical composition including same	20160708
US-2019142809-A1	Benzo[D]Thiazole Derivative Or Salt Thereof, And Pharmaceutical Composition Including Same	20160708

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Complexity:	132
Compound Is Canonicalized:	Yes
Covalently-Bonded Unit Count:	1
Defined Atom Stereocenter Count:	0
Defined Bond Stereocenter Count:	0
Exact Mass:	185.0607417
Formal Charge:	0
Heavy Atom Count:	12
Hydrogen Bond Acceptor Count:	2
Hydrogen Bond Donor Count:	1
Isotope Atom Count:	0
Monoisotopic Mass:	185.0607417
Rotatable Bond Count:	3
Topological Polar Surface Area:	35.2
Undefined Atom Stereocenter Count:	0
Undefined Bond Stereocenter Count:	0
XLogP3:	1.8