4-(1-Pyrazolyl)benzonitrile

Name: 4-(1-Pyrazolyl)benzonitrile
SKU: ACM25699836-1
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Catalog NumberACM25699836-1

CAS Number25699-83-6

CategoryLigands for Functional Metal Complexes

IUPAC Name

4-pyrazol-1-ylbenzonitrile

Molecular Weight

169.18g/mol

Molecular Formula

C10H7N3

Canonical SMILES

C1=CN(N=C1)C2=CC=C(C=C2)C#N

InChI

InChI=1S/C10H7N3/c11-8-9-2-4-10(5-3-9)13-7-1-6-12-13/h1-7H

InChI Key

SLPWCEHHSRUSKN-UHFFFAOYSA-N

Complexity

210

Covalently-Bonded Unit Count

Exact Mass

169.063997g/mol

Formal Charge

Heavy Atom Count

Monoisotopic Mass

169.063997g/mol

Rotatable Bond Count

XLogP3

1.9

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