7-Chloro-2-methylbenzoxazole - CAS 126892-02-2

Catalog:	BB006697
Product Name:	7-Chloro-2-methylbenzoxazole
CAS:	126892-02-2
Synonyms:	7-chloro-2-methyl-1,3-benzoxazole; 7-chloro-2-methyl-1,3-benzoxazole

Technical Data

Patents

Computed Properties

IUPAC Name:	7-chloro-2-methyl-1,3-benzoxazole
Description:	7-Chloro-2-methylbenzoxazole (CAS# 126892-02-2 ) is a useful research chemical.
Molecular Weight:	167.59
Molecular Formula:	C8H6ClNO
Canonical SMILES:	CC1=NC2=C(O1)C(=CC=C2)Cl
InChI:	InChI=1S/C8H6ClNO/c1-5-10-7-4-2-3-6(9)8(7)11-5/h2-4H,1H3
InChI Key:	SUGFZJVFEWSWIA-UHFFFAOYSA-N
LogP:	2.78960

Publication Number	Title	Priority Date
WO-2021113698-A1	Masp-2 inhibitors and methods of use	20191204
WO-2021063404-A1	Compound as small molecule inhibitor pd-1/pd-l1 and application thereof	20190930
CN-110382499-A	FGFR inhibitor and its application	20170227
US-2019127361-A1	Therapeutic Compounds	20160620
US-10851096-B2	Aryl and heteroaryl amides for use as anti-proliferative, anti-thrombotic, and anti-viral agents	20160620

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Complexity:	153
Compound Is Canonicalized:	Yes
Covalently-Bonded Unit Count:	1
Defined Atom Stereocenter Count:	0
Defined Bond Stereocenter Count:	0
Exact Mass:	167.0137915
Formal Charge:	0
Heavy Atom Count:	11
Hydrogen Bond Acceptor Count:	2
Hydrogen Bond Donor Count:	0
Isotope Atom Count:	0
Monoisotopic Mass:	167.0137915
Rotatable Bond Count:	0
Topological Polar Surface Area:	26
Undefined Atom Stereocenter Count:	0
Undefined Bond Stereocenter Count:	0
XLogP3:	2.8