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6-Bromo-1-methyl-2(1H)-pyridone

6-Bromo-1-methyl-2(1H)-pyridone - CAS 873383-11-0

Catalog:	BB038385
Product Name:	6-Bromo-1-methyl-2(1H)-pyridone
CAS:	873383-11-0
Synonyms:	6-bromo-1-methyl-2-pyridinone; 6-bromo-1-methylpyridin-2-one

Technical Data

Safety and Hazards

Patents

Computed Properties

IUPAC Name:	6-bromo-1-methylpyridin-2-one
Description:	6-Bromo-1-methyl-2(1H)-pyridone (CAS# 873383-11-0) is a useful research chemical.
Molecular Weight:	188.02
Molecular Formula:	C6H6BrNO
Canonical SMILES:	CN1C(=O)C=CC=C1Br
InChI:	InChI=1S/C6H6BrNO/c1-8-5(7)3-2-4-6(8)9/h2-4H,1H3
InChI Key:	PUHNNXVBAOPJPW-UHFFFAOYSA-N
Boiling Point:	287.109 °C at 760 mmHg
Density:	1.665 g/cm³
LogP:	1.14780

Publication Number	Title	Priority Date
WO-2021160087-A1	Quinolyl phosphine oxide compound, and composition and application thereof	20200214
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WO-2020221239-A1	Oxaazaquinazoline-7(8h)-ketone compound, preparation method therfor and pharmaceutical application thereof	20190428

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GHS Hazard Statement:	H302 (100%): Harmful if swallowed [Warning Acute toxicity, oral]
Precautionary Statement:	P261, P264, P270, P271, P280, P301+P312, P302+P352, P304+P340, P305+P351+P338, P312, P321, P330, P332+P313, P337+P313, P362, P403+P233, P405, and P501
Signal Word:	Warning

Complexity:	195
Compound Is Canonicalized:	Yes
Covalently-Bonded Unit Count:	1
Defined Atom Stereocenter Count:	0
Defined Bond Stereocenter Count:	0
Exact Mass:	186.96328
Formal Charge:	0
Heavy Atom Count:	9
Hydrogen Bond Acceptor Count:	1
Hydrogen Bond Donor Count:	0
Isotope Atom Count:	0
Monoisotopic Mass:	186.96328
Rotatable Bond Count:	0
Topological Polar Surface Area:	20.3 Å²
Undefined Atom Stereocenter Count:	0
Undefined Bond Stereocenter Count:	0
XLogP3:	1.3