1-(2-Methyl-3-pyridyl)ethanone - CAS 1721-12-6

Name: 1-(2-Methyl-3-pyridyl)ethanone
Brand: BOC Sciences
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Catalog:	BB012793
Product Name:	1-(2-Methyl-3-pyridyl)ethanone
CAS:	1721-12-6
Synonyms:	1-(2-methyl-3-pyridinyl)ethanone; 1-(2-methylpyridin-3-yl)ethanone

Technical Data

Safety and Hazards

Patents

Computed Properties

IUPAC Name:	1-(2-methylpyridin-3-yl)ethanone
Description:	1-(2-Methyl-3-pyridyl)ethanone (CAS# 1721-12-6 ) is a useful research chemical.
Molecular Weight:	135.16
Molecular Formula:	C8H9NO
Canonical SMILES:	CC1=C(C=CC=N1)C(=O)C
InChI:	InChI=1S/C8H9NO/c1-6-8(7(2)10)4-3-5-9-6/h3-5H,1-2H3
InChI Key:	NNBYTRDSKTZTGA-UHFFFAOYSA-N
Boiling Point:	226 °C
Density:	1.036 g/cm³
LogP:	1.59260

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Related Functional Groups

Carbonyl Compounds

[89908-23-6]C23H22N2O5
2-Propenoic acid, 2-(3',3'-dimethyl-6-nitrospiro[2H-1-benzopyran-2,2'-[2H]indol]-1'(3'H)-yl)ethyl ester
[959574-98-2]C11H10N2O2
(3-Phenyl-1H-pyrazol-1-yl)acetic acid
[253429-30-0]C12H16BrFO3
1-Bromo-2-(2,2-diethoxyethoxy)-4-fluorobenzene
[91552-11-3]C10H9ClO2
2-(3-Chlorophenyl)cyclopropanecarboxylic Acid
[865774-78-3]C16H21F2NO2
2-(6,8-difluoro-1,2,3,4-tetrahydro-naphthalen-2-ylamino)-pentanoic acid methyl ester
[104496-91-5]C7H9N3OS
2-(Pyridin-2-ylthio)acetohydrazide

GHS Hazard Statement:	H315 (100%): Causes skin irritation [Warning Skin corrosion/irritation]
Precautionary Statement:	P261, P264, P271, P280, P302+P352, P304+P340, P305+P351+P338, P312, P321, P332+P313, P337+P313, P362, P403+P233, P405, and P501
Signal Word:	Warning

Publication Number	Title	Priority Date
US-2021188857-A1	Sos1 inhibitors	20191220
US-2021171500-A1	Triazole carbamate pyridyl sulfonamides as lpa receptor antagonists and uses thereof	20191115
WO-2021023813-A1	5-heteroaryl-pyridin-2-amine confounds as neuropeptide ff receptor antagonists	20190806
CN-107856383-A	A kind of corona-resistant polyimide laminated film and preparation method thereof	20171207
CN-107856383-B	Corona-resistant polyimide composite film and preparation method thereof	20171207

Complexity:	133
Compound Is Canonicalized:	Yes
Covalently-Bonded Unit Count:	1
Defined Atom Stereocenter Count:	0
Defined Bond Stereocenter Count:	0
Exact Mass:	135.068413911
Formal Charge:	0
Heavy Atom Count:	10
Hydrogen Bond Acceptor Count:	2
Hydrogen Bond Donor Count:	0
Isotope Atom Count:	0
Monoisotopic Mass:	135.068413911
Rotatable Bond Count:	1
Topological Polar Surface Area:	30 Å²
Undefined Atom Stereocenter Count:	0
Undefined Bond Stereocenter Count:	0
XLogP3:	0.9