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6-Chloro-2-methylbenzoxazole

6-Chloro-2-methylbenzoxazole - CAS 63816-18-2

Catalog:	BB032289
Product Name:	6-Chloro-2-methylbenzoxazole
CAS:	63816-18-2
Synonyms:	6-chloro-2-methyl-1,3-benzoxazole; 6-chloro-2-methyl-1,3-benzoxazole

Technical Data

Patents

Computed Properties

IUPAC Name:	6-chloro-2-methyl-1,3-benzoxazole
Description:	6-Chloro-2-methylbenzoxazole (CAS# 63816-18-2 ) is a useful research chemical.
Molecular Weight:	167.59
Molecular Formula:	C8H6ClNO
Canonical SMILES:	CC1=NC2=C(O1)C=C(C=C2)Cl
InChI:	InChI=1S/C8H6ClNO/c1-5-10-7-3-2-6(9)4-8(7)11-5/h2-4H,1H3
InChI Key:	LAZJZCLGDISMLM-UHFFFAOYSA-N
Boiling Point:	241.6 °C at 760 mmHg
Density:	1.311 g/cm³
LogP:	2.78960

Publication Number	Title	Priority Date
US-2020390100-A1	Substituted n-heterocyclyl- and n-heteroaryl-tetrahydropyrimidinones and the salts thereof, and the use of same as herbicidal active substances	20171219
US-2020216462-A1	4-Sulfur Substituted Podophyllotoxin Derivative and Preparation Method Therefor and Use Thereof	20170922
CN-110382499-A	FGFR inhibitor and its application	20170227
US-2020345700-A1	Lsd1 inhibitor and preparation method and application thereof	20170124
WO-2018114596-A1	Substituted heteroaryl pyrrolones and salts thereof and use thereof as herbicidal active substances	20161222

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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