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1-(2,4-Dichlorophenyl)cyclopropanecarbonitrile

1-(2,4-Dichlorophenyl)cyclopropanecarbonitrile - CAS 71463-55-3

Catalog:	BB034383
Product Name:	1-(2,4-Dichlorophenyl)cyclopropanecarbonitrile
CAS:	71463-55-3
Synonyms:	1-(2,4-dichlorophenyl)-1-cyclopropanecarbonitrile; 1-(2,4-dichlorophenyl)cyclopropane-1-carbonitrile

Technical Data

Safety and Hazards

Patents

Computed Properties

IUPAC Name:	1-(2,4-dichlorophenyl)cyclopropane-1-carbonitrile
Description:	1-(2,4-Dichlorophenyl)cyclopropanecarbonitrile (CAS# 71463-55-3 ) is a useful research chemical.
Molecular Weight:	212.08
Molecular Formula:	C10H7Cl2N
Canonical SMILES:	C1CC1(C#N)C2=C(C=C(C=C2)Cl)Cl
InChI:	InChI=1S/C10H7Cl2N/c11-7-1-2-8(9(12)5-7)10(6-13)3-4-10/h1-2,5H,3-4H2
InChI Key:	VDKKBWVLLSVWKI-UHFFFAOYSA-N
Boiling Point:	337.4 °C at 760 mmHg
Density:	1.38 g/cm³
LogP:	3.54858

Publication Number	Title	Priority Date
AU-2018367119-A1	Process for the preparation of enantiomerically and diastereomerically enriched cyclobutane amines and amides	20171116
CA-3082558-A1	Process for the preparation of enantiomerically and diastereomerically enriched cyclobutane amines and amides	20171116
TW-201936558-A	Method for preparing cyclobutane amine and cyclobutane decylamine rich in mirror image isomers and non-image material isomers	20171116
WO-2019096860-A1	Process for the preparation of enantiomerically and diastereomerically enriched cyclobutane amines and amides	20171116
BR-112020009787-A2	process for the preparation of enantiomerically and diastereomerically enriched amines and cyclobutane amides	20171116

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Related Functional Groups

Nitrogen Compounds

[1281984-38-0]
1-Cyclopentyl-3,5-dinitro-1H-pyrazole
[865774-78-3]
2-(6,8-difluoro-1,2,3,4-tetrahydro-naphthalen-2-ylamino)-pentanoic acid methyl ester
[158387-00-9]
3-Oxo-3-(1,3,5-trimethyl-1H-pyrazol-4-yl)propanenitrile
[1256633-32-5]
4,5-Isoxazoledicarbonitrile
[512809-77-7]
5-[(3,5-Dimethyl-4-nitro-1H-pyrazol-1-yl)methyl]furan-2-carbaldehyde
[614-16-4]
Benzoylacetonitrile

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GHS Hazard Statement:	H302 (98.44%): Harmful if swallowed [Warning Acute toxicity, oral]
Precautionary Statement:	P261, P264, P270, P272, P280, P301+P312, P302+P352, P312, P321, P322, P330, P333+P313, P361, P363, P405, and P501
Signal Word:	Danger

Complexity:	251
Compound Is Canonicalized:	Yes
Covalently-Bonded Unit Count:	1
Defined Atom Stereocenter Count:	0
Defined Bond Stereocenter Count:	0
Exact Mass:	210.9955546
Formal Charge:	0
Heavy Atom Count:	13
Hydrogen Bond Acceptor Count:	1
Hydrogen Bond Donor Count:	0
Isotope Atom Count:	0
Monoisotopic Mass:	210.9955546
Rotatable Bond Count:	1
Topological Polar Surface Area:	23.8 Å²
Undefined Atom Stereocenter Count:	0
Undefined Bond Stereocenter Count:	0
XLogP3:	3.2