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5-chloropyrazolo[1,5-a]pyrimidine-3-carbonitrile

5-chloropyrazolo[1,5-a]pyrimidine-3-carbonitrile

CAS: 1224288-92-9

Formula: C7H3ClN4

SMILES: ClC1=NC2=C(C=NN2C=C1)C#N

IUPAC: 5-chloropyrazolo[1,5-a]pyrimidine-3-carbonitrile

InChI: InChI=1S/C7H3ClN4/c8-6-1-2-12-7(11-6)5(3-9)4-10-12/h1-2,4H

Composition: C (47.08%), H (1.69%), Cl (19.85%), N (31.37%)

Molar Mass: 178.58

Atom Count: 15

Heavy Atom Count: 12

Properties
Properties
Common Names N/A
Aromatic Ring Count 2
Asymmetric Atom Count 0
Exact Mass 178.0046238
Formal Charge 0
FSP3 0
Hetero Ring Count 2
Hydrogen Bond Acceptor Count 3
Hydrogen Bond Donor Count 0
InChIKey OYGONYREIXSORZ-UHFFFAOYSA-N
Lipinski's Rule of Five 1
Molar Refractivity 55.36
Topological Polar Surface Area 53.98
Polarizability 16.24
Ring Count 2
Rotatable Bond Count 0

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