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4-(1-Pyrazolyl)benzonitrile

Catalog Number
ACM25699836-1
Product Name
4-(1-Pyrazolyl)benzonitrile
Structure
CAS
25699-83-6
Category
Ligands 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
1
Exact Mass
169.063997g/mol
Formal Charge
0
Heavy Atom Count
13
Monoisotopic Mass
169.063997g/mol
Rotatable Bond Count
1
XLogP3
1.9
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