5-Amino-3,4-dihydronaphthalen-1(2H)-one - CAS 41823-28-3

Catalog:	BB024972
Product Name:	5-Amino-3,4-dihydronaphthalen-1(2H)-one
CAS:	41823-28-3
Synonyms:	5-amino-3,4-dihydro-2H-naphthalen-1-one; 5-amino-3,4-dihydro-2H-naphthalen-1-one

Technical Data

Patents

Computed Properties

IUPAC Name:	5-amino-3,4-dihydro-2H-naphthalen-1-one
Description:	5-Amino-3,4-dihydronaphthalen-1(2H)-one (CAS# 41823-28-3) is a useful research chemical.
Molecular Weight:	161.20
Molecular Formula:	C10H11NO
Canonical SMILES:	C1CC2=C(C=CC=C2N)C(=O)C1
InChI:	InChI=1S/C10H11NO/c11-9-5-1-4-8-7(9)3-2-6-10(8)12/h1,4-5H,2-3,6,11H2
InChI Key:	MGMLEKRIIOQCIJ-UHFFFAOYSA-N
LogP:	2.36900

Publication Number	Title	Priority Date
US-2019071380-A1	Naphthoquinones, pro-drugs, and methods of use thereof	20151218
WO-2017106624-A1	Napthoquinones, pro-drugs, and methods of use thereof	20151218
US-10829427-B2	Naphthoquinones, pro-drugs, and methods of use thereof	20151218
AU-2004266191-A1	(1,8)naphthyridin-2-ones and related compounds for the treatment of schizophrenia	20030822
AU-2004266191-B2	(1,8)naphthyridin-2-ones and related compounds for the treatment of schizophrenia	20030822

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Complexity:	190
Compound Is Canonicalized:	Yes
Covalently-Bonded Unit Count:	1
Defined Atom Stereocenter Count:	0
Defined Bond Stereocenter Count:	0
Exact Mass:	161.084063974
Formal Charge:	0
Heavy Atom Count:	12
Hydrogen Bond Acceptor Count:	2
Hydrogen Bond Donor Count:	1
Isotope Atom Count:	0
Monoisotopic Mass:	161.084063974
Rotatable Bond Count:	0
Topological Polar Surface Area:	43.1
Undefined Atom Stereocenter Count:	0
Undefined Bond Stereocenter Count:	0
XLogP3:	1.8