91091-13-3
5-AMINO-1-BENZYL-1H-PYRAZOLE-4-CARBONITRILE
Name
5-AMINO-1-BENZYL-1H-PYRAZOLE-4-CARBONITRILE
Formula
C11 H10 N4
MolWeight
198.228
1Identification
【Name】
5-AMINO-1-BENZYL-1H-PYRAZOLE-4-CARBONITRILE
【CAS】
【MDL】
MFCD00128291
【English Synonyms】
【Formula】
C11 H10 N4
【MolWeight】
198.228
【Inchi】
InChI=1S/C11H10N4/c12-6-10-7-14-15(11(10)13)8-9-4-2-1-3-5-9/h1-5,7H,8,13H2
【InChIKey】
InChIKey=GAVXFBPVQOBHDS-UHFFFAOYSA-N
【SMILES】
c1ccc(cc1)Cn2c(c(cn2)C#N)N
【MOL File】
2Chemical and Physical Properties
【Computed Properties】
H bond donor:1
H bond acceptor:4
XLogP3:1.0
Bulk/Fine:FB
3Material Safety Data Sheet(MSDS)
4CML File
5-AMINO-1-BENZYL-1H-PYRAZOLE-4-CARBONITRILE.cml
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