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338786-45-1
2-(CYANOMETHYL)-5,7-BIS(TRIFLUOROMETHYL)PYRAZOLO[1,5-A]PYRIMIDINE-3-CARBONITRILE
Name
2-(CYANOMETHYL)-5,7-BIS(TRIFLUOROMETHYL)PYRAZOLO[1,5-A]PYRIMIDINE-3-CARBONITRILE
Formula
C11 H3 F6 N5
MolWeight
319.168
1Identification
【Name】
2-(CYANOMETHYL)-5,7-BIS(TRIFLUOROMETHYL)PYRAZOLO[1,5-A]PYRIMIDINE-3-CARBONITRILE
【CAS】
【MDL】
MFCD00141799
【English Synonyms】
【Formula】
C11 H3 F6 N5
【MolWeight】
319.168
【Inchi】
InChI=1S/C11H3F6N5/c12-10(13,14)7-3-8(11(15,16)17)22-9(20-7)5(4-19)6(21-22)1-2-18/h3H,1H2
【InChIKey】
InChIKey=LHFMDQKRTYVJPL-UHFFFAOYSA-N
【SMILES】
c1c(nc2c(c(nn2c1C(F)(F)F)CC#N)C#N)C(F)(F)F
【MOL File】
2Chemical and Physical Properties
【Computed Properties】
H bond donor:0
H bond acceptor:5
XLogP3:1.0
Bulk/Fine:FB
3Material Safety Data Sheet(MSDS)
4CML File
2-(CYANOMETHYL)-5,7-BIS(TRIFLUOROMETHYL)PYRAZOLO[1,5-A]PYRIMIDINE-3-CARBONITRILE.cml
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