5-Hydroxy-3-(4-methoxyphenyl)isoxazole - CAS 53949-09-0

Catalog:	BB028411
Product Name:	5-Hydroxy-3-(4-methoxyphenyl)isoxazole
CAS:	53949-09-0
Synonyms:	3-(4-methoxyphenyl)-2H-isoxazol-5-one; 3-(4-methoxyphenyl)-2H-1,2-oxazol-5-one

Technical Data

Patents

Computed Properties

IUPAC Name:	3-(4-methoxyphenyl)-2H-1,2-oxazol-5-one
Description:	5-Hydroxy-3-(4-methoxyphenyl)isoxazole (CAS# 53949-09-0 ) is a useful research chemical.
Molecular Weight:	191.18
Molecular Formula:	C10H9NO3
Canonical SMILES:	COC1=CC=C(C=C1)C2=CC(=O)ON2
InChI:	InChI=1S/C10H9NO3/c1-13-8-4-2-7(3-5-8)9-6-10(12)14-11-9/h2-6,11H,1H3
InChI Key:	BNNYWWWHXRXHGK-UHFFFAOYSA-N
LogP:	2.05580

Publication Number	Title	Priority Date
JP-H06324493-A	Positive photosensitive polyimide precursor composition	19930513
EP-0446010-A1	Imidazole derivatives and antiepileptics comprising said imidazole derivatives as effective ingredients	19900306
EP-0446010-B1	Imidazole derivatives and antiepileptics comprising said imidazole derivatives as effective ingredients	19900306
US-5112841-A	Imidazole derivatives and antiepileptics comprising said imidazole derivatives as effective ingredients	19900306
US-4259432-A	Photopolymerizable compositions having combined photoinitiators	19781006

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Complexity:	254
Compound Is Canonicalized:	Yes
Covalently-Bonded Unit Count:	1
Defined Atom Stereocenter Count:	0
Defined Bond Stereocenter Count:	0
Exact Mass:	191.058243149
Formal Charge:	0
Heavy Atom Count:	14
Hydrogen Bond Acceptor Count:	4
Hydrogen Bond Donor Count:	1
Isotope Atom Count:	0
Monoisotopic Mass:	191.058243149
Rotatable Bond Count:	2
Topological Polar Surface Area:	47.6
Undefined Atom Stereocenter Count:	0
Undefined Bond Stereocenter Count:	0
XLogP3:	1.9