8-Chloro-4-hydroxy-2-phenylquinoline - CAS 439147-12-3

Catalog:	BB025495
Product Name:	8-Chloro-4-hydroxy-2-phenylquinoline
CAS:	439147-12-3
Synonyms:	8-chloro-2-phenyl-1H-quinolin-4-one

Technical Data

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Computed Properties

IUPAC Name:	8-chloro-2-phenyl-1H-quinolin-4-one
Description:	8-Chloro-4-hydroxy-2-phenylquinoline (CAS# 439147-12-3) is a useful research chemical.
Molecular Weight:	255.70
Molecular Formula:	C15H10ClNO
Canonical SMILES:	C1=CC=C(C=C1)C2=CC(=O)C3=C(N2)C(=CC=C3)Cl
InChI:	InChI=1S/C15H10ClNO/c16-12-8-4-7-11-14(18)9-13(17-15(11)12)10-5-2-1-3-6-10/h1-9H,(H,17,18)
InChI Key:	FKESBVHFFXMUOC-UHFFFAOYSA-N
Boiling Point:	416.9 °C at 760 mmHg
Density:	1.303 g/cm³
LogP:	4.26080

Publication Number	Title	Priority Date
CN-109516973-A	Substituted uracil compound, preparation method and the usage	20170919
CN-109516975-A	The officinal salt and preparation method thereof of substituted uracil PI3K inhibitor	20170919
KR-101975323-B1	Substituted pyrimidine compounds as phosphatidylinositol 3-kinase Î´ inhibitor and use thereof	20150306
KR-20170113630-A	Substituted pyrimidine compounds as phosphatidylinositol 3-kinase Î´ inhibitor and use thereof	20150306
WO-2010033466-A1	Macrocyclic inhibitors of hepatitis c protease	20080916

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Related Functional Groups

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GHS Hazard Statement:	H301 (100%): Toxic if swallowed [Danger Acute toxicity, oral]; H318 (100%): Causes serious eye damage [Danger Serious eye damage/eye irritation]; H413 (100%): May cause long lasting harmful effects to aquatic life [Hazardous to the aquatic environment, long-term hazard]
Precautionary Statement:	P264, P264+P265, P270, P273, P280, P301+P316, P305+P354+P338, P317, P321, P330, P405, and P501
Signal Word:	Danger

Complexity:	360
Compound Is Canonicalized:	Yes
Covalently-Bonded Unit Count:	1
Defined Atom Stereocenter Count:	0
Defined Bond Stereocenter Count:	0
Exact Mass:	255.0450916
Formal Charge:	0
Heavy Atom Count:	18
Hydrogen Bond Acceptor Count:	2
Hydrogen Bond Donor Count:	1
Isotope Atom Count:	0
Monoisotopic Mass:	255.0450916
Rotatable Bond Count:	1
Topological Polar Surface Area:	29.1
Undefined Atom Stereocenter Count:	0
Undefined Bond Stereocenter Count:	0
XLogP3:	3.8