Phenyl N- (2- Chloro- 4- hydroxyphenyl) carbamate - CAS 796848-80-1

Name: Phenyl N- (2- Chloro- 4- hydroxyphenyl) carbamate
Brand: BOC Sciences
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Catalog:	BB058182
Product Name:	Phenyl N- (2- Chloro- 4- hydroxyphenyl) carbamate
CAS:	796848-80-1
Synonyms:	phenyl (2-chloro-4-hydroxyphenyl)carbamate; Phenyl N-(2-chloro-4-hydroxyphenyl)carbamate; Carbamic acid, (2-chloro-4-hydroxyphenyl)-, phenyl ester; phenyl 2-chloro-4-hydroxyphenylcarbaMate

Technical Data

IUPAC Name:	phenyl N-(2-chloro-4-hydroxyphenyl)carbamate
Description:	Phenyl N- (2- Chloro- 4- hydroxyphenyl) carbamate is a reagent used in the prepartion of quinoline-carboxamide compounds including Lenvatinib (L329400), an orally active inhibitor of multiple receptor tyrosine kinases including VEGF, FGF and SCF receptors.
Molecular Weight:	263.68
Molecular Formula:	C13H10ClNO3
Canonical SMILES:	C1=CC=C(C=C1)OC(=O)NC2=C(C=C(C=C2)O)Cl
InChI:	InChI=1S/C13H10ClNO3/c14-11-8-9(16)6-7-12(11)15-13(17)18-10-4-2-1-3-5-10/h1-8,16H,(H,15,17)
InChI Key:	LBDLNHLYEKFAHH-UHFFFAOYSA-N
References:	Wang, N. et al. Faming Zhuanli Shenqing (2017), CN 106632033 A 20170510..

Complexity:	281
Compound Is Canonicalized:	Yes
Covalently-Bonded Unit Count:	1
Defined Atom Stereocenter Count:	0
Defined Bond Stereocenter Count:	0
Exact Mass:	263.0349209
Formal Charge:	0
Heavy Atom Count:	18
Hydrogen Bond Acceptor Count:	3
Hydrogen Bond Donor Count:	2
Isotope Atom Count:	0
Monoisotopic Mass:	263.0349209
Rotatable Bond Count:	3
Topological Polar Surface Area:	58.6Å²
Undefined Atom Stereocenter Count:	0
Undefined Bond Stereocenter Count:	0
XLogP3:	3.2