95834-35-8
1-PHENYL-5-(1H-PYRROL-1-YL)-1H-PYRAZOLE-4-CARBONITRILE
Name
1-PHENYL-5-(1H-PYRROL-1-YL)-1H-PYRAZOLE-4-CARBONITRILE
Formula
C14 H10 N4
MolWeight
234.261
1Identification
【Name】
1-PHENYL-5-(1H-PYRROL-1-YL)-1H-PYRAZOLE-4-CARBONITRILE
【CAS】
【MDL】
MFCD00052245
【English Synonyms】
【Formula】
C14 H10 N4
【MolWeight】
234.261
【Inchi】
InChI=1S/C14H10N4/c15-10-12-11-16-18(13-6-2-1-3-7-13)14(12)17-8-4-5-9-17/h1-9,11H
【InChIKey】
InChIKey=CLPBUILTGSQXDN-UHFFFAOYSA-N
【SMILES】
c1ccc(cc1)n2c(c(cn2)C#N)n3cccc3
【MOL File】
2Chemical and Physical Properties
【Computed Properties】
H bond donor:0
H bond acceptor:4
XLogP3:2.0
Bulk/Fine:FB
3Material Safety Data Sheet(MSDS)
4CML File
1-PHENYL-5-(1H-PYRROL-1-YL)-1H-PYRAZOLE-4-CARBONITRILE.cml
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