2-(azetidin-3-yl)acetonitrile hydrochloride - CAS 1423057-36-6

Catalog:	BB009352
Product Name:	2-(azetidin-3-yl)acetonitrile hydrochloride
CAS:	1423057-36-6
Synonyms:	2-(3-azetidinyl)acetonitrile;hydrochloride; 2-(azetidin-3-yl)acetonitrile;hydrochloride

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Computed Properties

IUPAC Name:	2-(azetidin-3-yl)acetonitrile;hydrochloride
Description:	2-(azetidin-3-yl)acetonitrile hydrochloride (CAS# 1423057-36-6) is a useful research chemical.
Molecular Weight:	132.591
Molecular Formula:	C5H9ClN2
Canonical SMILES:	C1C(CN1)CC#N.Cl
InChI:	InChI=1S/C5H8N2.ClH/c6-2-1-5-3-7-4-5;/h5,7H,1,3-4H2;1H
InChI Key:	SJSKCHPFJJQTBK-UHFFFAOYSA-N

Publication Number	Title	Priority Date
CN-113348170-A	Biphenyl derivative inhibitor, preparation method and application thereof	20200103
WO-2021136354-A1	Biphenyl derivative inhibitor, preparation method therefor and use thereof	20200103
CN-112010864-A	Vascular endothelial growth factor receptor inhibitor and preparation method and application thereof	20190531
AU-2012295802-A1	Tricyclic heterocyclic compounds and JAK inhibitors	20110812
AU-2012295802-B2	Tricyclic heterocyclic compounds and JAK inhibitors	20110812

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GHS Hazard Statement:	H303 (100%): May be harmful if swallowed [Warning Acute toxicity, oral]
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

Complexity:	95.9
Compound Is Canonicalized:	Yes
Covalently-Bonded Unit Count:	2
Defined Atom Stereocenter Count:	0
Defined Bond Stereocenter Count:	0
Exact Mass:	132.0454260
Formal Charge:	0
Heavy Atom Count:	8
Hydrogen Bond Acceptor Count:	2
Hydrogen Bond Donor Count:	2
Isotope Atom Count:	0
Monoisotopic Mass:	132.0454260
Rotatable Bond Count:	1
Topological Polar Surface Area:	35.8 Å²
Undefined Atom Stereocenter Count:	0
Undefined Bond Stereocenter Count:	0