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1-(3,4-dichlorophenyl)cyclopropane-1-carbonitrile

1-(3,4-dichlorophenyl)cyclopropane-1-carbonitrile

CAS: 124276-57-9

Formula: C10H7Cl2N

SMILES: ClC1=C(Cl)C=C(C=C1)C1(CC1)C#N

IUPAC: 1-(3,4-dichlorophenyl)cyclopropane-1-carbonitrile

InChI: InChI=1S/C10H7Cl2N/c11-8-2-1-7(5-9(8)12)10(6-13)3-4-10/h1-2,5H,3-4H2

Composition: C (56.64%), H (3.33%), Cl (33.43%), N (6.60%)

Molar Mass: 212.07

Atom Count: 20

Heavy Atom Count: 13

Properties
Properties
Common Names N/A
Aromatic Ring Count 1
Asymmetric Atom Count 0
Exact Mass 210.9955546
Formal Charge 0
FSP3 0.3
Hetero Ring Count 0
Hydrogen Bond Acceptor Count 1
Hydrogen Bond Donor Count 0
InChIKey SJDZLTHRJVBKJM-UHFFFAOYSA-N
Lipinski's Rule of Five 1
Molar Refractivity 53.23
Topological Polar Surface Area 23.79
Polarizability 20.59
Ring Count 2
Rotatable Bond Count 1

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