7-Chlorobenzoxazole - CAS 1243378-99-5

Catalog:	BB005879
Product Name:	7-Chlorobenzoxazole
CAS:	1243378-99-5
Synonyms:	7-chloro-1,3-benzoxazole; 7-chloro-1,3-benzoxazole

Technical Data

Patents

Computed Properties

IUPAC Name:	7-chloro-1,3-benzoxazole
Description:	7-Chlorobenzoxazole (CAS# 1243378-99-5) is a useful research chemical.
Molecular Weight:	153.57
Molecular Formula:	C7H4ClNO
Canonical SMILES:	C1=CC2=C(C(=C1)Cl)OC=N2
InChI:	InChI=1S/C7H4ClNO/c8-5-2-1-3-6-7(5)10-4-9-6/h1-4H
InChI Key:	AGSFPLMLEMCOFX-UHFFFAOYSA-N
Storage:	Sealed in dry, 2-8 °C
LogP:	2.48120

Publication Number	Title	Priority Date
EP-2736337-A1	Certain kynurenine-3-monooxygenase inhibitors, pharmaceutical compositions, and methods of use thereof	20110728
US-2014329816-A1	Certain kynurenine-3-monooxygenase inhibitors, pharmaceutical compositions, and methods of use thereof	20110728
WO-2013016488-A1	Certain kynurenine-3-monooxygenase inhibitors, pharmaceutical compositions, and methods of use thereof	20110728
US-2011257014-A1	1-(Heteroaryl)pyrazol-4-ylacetic acids, processes for their preparation and their use as herbicides and plant growth regulators	20091215
WO-2011073098-A1	1-(heteroaryl)-pyrazol-4-yl-acetic acids, method for the production thereof, and the use thereof as herbicides and plant growth regulators	20091215

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Complexity:	131
Compound Is Canonicalized:	Yes
Covalently-Bonded Unit Count:	1
Defined Atom Stereocenter Count:	0
Defined Bond Stereocenter Count:	0
Exact Mass:	152.9981414
Formal Charge:	0
Heavy Atom Count:	10
Hydrogen Bond Acceptor Count:	2
Hydrogen Bond Donor Count:	0
Isotope Atom Count:	0
Monoisotopic Mass:	152.9981414
Rotatable Bond Count:	0
Topological Polar Surface Area:	26
Undefined Atom Stereocenter Count:	0
Undefined Bond Stereocenter Count:	0
XLogP3:	2.4