773140-12-8
BENZAMIDE, N-(4-CYANO-1,3-DIMETHYL-1H-PYRAZOL-5-YL)-2-FLUORO-
Name
BENZAMIDE, N-(4-CYANO-1,3-DIMETHYL-1H-PYRAZOL-5-YL)-2-FLUORO-
Formula
C13 H11 F N4 O
MolWeight
258.255
1Identification
【Name】
BENZAMIDE, N-(4-CYANO-1,3-DIMETHYL-1H-PYRAZOL-5-YL)-2-FLUORO-
【CAS】
【MDL】
MFCD08099252
【English Synonyms】
【Formula】
C13 H11 F N4 O
【MolWeight】
258.255
【Inchi】
InChI=1S/C13H11FN4O/c1-8-10(7-15)12(18(2)17-8)16-13(19)9-5-3-4-6-11(9)14/h3-6H,1-2H3,(H,16,19)
【InChIKey】
InChIKey=DIDIQNWVFHJHMP-UHFFFAOYSA-N
【SMILES】
Cc1c(c(n(n1)C)NC(=O)c2ccccc2F)C#N
【MOL File】
2Chemical and Physical Properties
【Computed Properties】
H bond donor:1
H bond acceptor:5
XLogP3:2.0
Bulk/Fine:F
3Material Safety Data Sheet(MSDS)
4CML File
BENZAMIDE, N-(4-CYANO-1,3-DIMETHYL-1H-PYRAZOL-5-YL)-2-FLUORO-.cml
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