7-Bromo-2-methylbenzoxazole - CAS 1239489-82-7

Catalog:	BB005763
Product Name:	7-Bromo-2-methylbenzoxazole
CAS:	1239489-82-7
Synonyms:	7-bromo-2-methyl-1,3-benzoxazole; 7-bromo-2-methyl-1,3-benzoxazole

Technical Data

Patents

Computed Properties

IUPAC Name:	7-bromo-2-methyl-1,3-benzoxazole
Description:	7-Bromo-2-methylbenzoxazole (CAS# 1239489-82-7) is a useful research chemical.
Molecular Weight:	212.04
Molecular Formula:	C8H6BrNO
Canonical SMILES:	CC1=NC2=C(O1)C(=CC=C2)Br
InChI:	InChI=1S/C8H6BrNO/c1-5-10-7-4-2-3-6(9)8(7)11-5/h2-4H,1H3
InChI Key:	BKDLGCJXIKUIRB-UHFFFAOYSA-N
Storage:	Sealed in dry, Room Temperature
MDL:	MFCD12965124
LogP:	2.89870

Publication Number	Title	Priority Date
US-2020032401-A1	Ultraviolet-stabilized corrosion inhibitors	20180725
US-10889901-B2	Ultraviolet-stabilized corrosion inhibitors	20180725
JP-2021521104-A	Substituted benzofurans, benzopyrroles, benzothiophenes, and structurally related complement inhibitors	20180406
TW-201927779-A	1H-pyrazolo[4,3-b]pyridine as a PDE1 inhibitor	20171220
US-2019194189-A1	1h-pyrazolo[4,3-b]pyridines as pde1 inhibitors	20171220

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Related Functional Groups

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[55202-46-5]
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[6481-01-2]
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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:	210.96328
Formal Charge:	0
Heavy Atom Count:	11
Hydrogen Bond Acceptor Count:	2
Hydrogen Bond Donor Count:	0
Isotope Atom Count:	0
Monoisotopic Mass:	210.96328
Rotatable Bond Count:	0
Topological Polar Surface Area:	26
Undefined Atom Stereocenter Count:	0
Undefined Bond Stereocenter Count:	0
XLogP3:	2.9