Cyclopropyl(2-pyridyl)methanone - CAS 57276-28-5

Catalog:	BB029624
Product Name:	Cyclopropyl(2-pyridyl)methanone
CAS:	57276-28-5
Synonyms:	cyclopropyl(2-pyridinyl)methanone; cyclopropyl(pyridin-2-yl)methanone

Technical Data

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Computed Properties

IUPAC Name:	cyclopropyl(pyridin-2-yl)methanone
Description:	Cyclopropyl(2-pyridyl)methanone (CAS# 57276-28-5) is a useful reactant for the synthesis of dihydronaphthalenes and dihydroquinolines.
Molecular Weight:	147.17
Molecular Formula:	C9H9NO
Canonical SMILES:	C1CC1C(=O)C2=CC=CC=N2
InChI:	InChI=1S/C9H9NO/c11-9(7-4-5-7)8-3-1-2-6-10-8/h1-3,6-7H,4-5H2
InChI Key:	BYBSSXPFERULBV-UHFFFAOYSA-N
Boiling Point:	246.1 °C at 760 mmHg
Density:	1.191 g/cm³
LogP:	1.67430

Publication Number	Title	Priority Date
WO-2021038068-A1	Alpha-d-galactopyranoside derivatives	20190829
EP-3611164-A1	Pyridone compound, and agricultural and horticultural fungicide having this as active component	20170410
CA-2861847-A1	Substituted phenylazole derivative	20120118
AU-2011261263-A1	Piperidinone derivatives as MDM2 inhibitors for the treatment of cancer	20100604
AU-2011261263-B2	Piperidinone derivatives as MDM2 inhibitors for the treatment of cancer	20100604

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Related Functional Groups

Carbonyl Compounds

[5650-34-0]
Oxiran-2-yl(phenyl)methanone
[1427004-19-0]
DBCO-PEG4-NHS ester
[1383427-98-2]
(S)-Hexahydropyrazino[2,1-c][1,4]oxazin-4(3H)-one hydrochloride
[70199-62-1]
(4-Pyridyl)acetone Hydrochloride
[1018141-88-2]
1-(2-Cyanoethyl)-3-methyl-6-phenyl-1H-pyrazolo[3,4-b]pyridine-4-carboxylic acid
[55441-25-3]
1-(2-Cyanophenyl)urea

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GHS Hazard Statement:	H302 (100%): Harmful if swallowed [Warning Acute toxicity, oral]; H315 (100%): Causes skin irritation [Warning Skin corrosion/irritation]; H319 (100%): Causes serious eye irritation [Warning Serious eye damage/eye irritation]; H335 (100%): May cause respiratory irritation [Warning Specific target organ toxicity, single exposure; Respiratory tract irritation]
Precautionary Statement:	P261, P264, P264+P265, P270, P271, P280, P301+P317, P302+P352, P304+P340, P305+P351+P338, P319, P321, P330, P332+P317, P337+P317, P362+P364, P403+P233, P405, and P501
Signal Word:	Warning

Complexity:	163
Compound Is Canonicalized:	Yes
Covalently-Bonded Unit Count:	1
Defined Atom Stereocenter Count:	0
Defined Bond Stereocenter Count:	0
Exact Mass:	147.068413911
Formal Charge:	0
Heavy Atom Count:	11
Hydrogen Bond Acceptor Count:	2
Hydrogen Bond Donor Count:	0
Isotope Atom Count:	0
Monoisotopic Mass:	147.068413911
Rotatable Bond Count:	2
Topological Polar Surface Area:	30
Undefined Atom Stereocenter Count:	0
Undefined Bond Stereocenter Count:	0
XLogP3:	1.3