(E)-Chroman-4-One Oxime - CAS 535935-39-8

Catalog:	BB028281
Product Name:	(E)-Chroman-4-One Oxime
CAS:	535935-39-8
Synonyms:	3,4-dihydro-2H-1-benzopyran-4-one oxime; N-(2,3-dihydrochromen-4-ylidene)hydroxylamine

Technical Data

Patents

Computed Properties

IUPAC Name:	(NE)-N-(2,3-dihydrochromen-4-ylidene)hydroxylamine
Description:	(E)-Chroman-4-One Oxime (CAS# 535935-39-8 ) is a useful research chemical.
Molecular Weight:	163.17
Molecular Formula:	C9H9NO2
Canonical SMILES:	C1COC2=CC=CC=C2C1=NO
InChI:	InChI=1S/C9H9NO2/c11-10-8-5-6-12-9-4-2-1-3-7(8)9/h1-4,11H,5-6H2
InChI Key:	LOWLISSVPQGXNV-UHFFFAOYSA-N
LogP:	1.64740

Publication Number	Title	Priority Date
US-2015111867-A1	Aminochromane, aminothiochromane and amino-1,2,3,4-tetrahydroquinoline derivatives, pharmaceutical compositions containing them, and their use in therapy	20131017
US-2017173009-A1	Aminochromane, aminothiochromane and amino-1,2,3,4-tetrahydroquinoline derivatives, pharmaceutical compositions containing them, and their use in therapy	20131017
US-2019290645-A1	Aminochromane, aminothiochromane and amino-1,2,3,4-tetrahydroquinoline derivatives, pharmaceutical compositions containing them, and their use in therapy	20131017
US-9586945-B2	Aminochromane, aminothiochromane and amino-1,2,3,4-tetrahydroquinoline derivatives, pharmaceutical compositions containing them, and their use in therapy	20131017
EP-2739614-B1	AMINOCHROMANEs, PHARMACEUTICAL COMPOSITIONS CONTAINING THEM, AND THEIR USE IN THERAPY	20110805

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Complexity:	191
Compound Is Canonicalized:	Yes
Covalently-Bonded Unit Count:	1
Defined Atom Stereocenter Count:	0
Defined Bond Stereocenter Count:	1
Exact Mass:	163.06332853
Formal Charge:	0
Heavy Atom Count:	12
Hydrogen Bond Acceptor Count:	3
Hydrogen Bond Donor Count:	1
Isotope Atom Count:	0
Monoisotopic Mass:	163.06332853
Rotatable Bond Count:	0
Topological Polar Surface Area:	41.8
Undefined Atom Stereocenter Count:	0
Undefined Bond Stereocenter Count:	0
XLogP3:	1.6