781663-74-9
3-BROMOMETHYL-N,5-DIPHENYL-PYRAZOLE
Name3-BROMOMETHYL-N,5-DIPHENYL-PYRAZOLE
1Identification
【Name】
3-BROMOMETHYL-N,5-DIPHENYL-PYRAZOLE
【CAS】
【MDL】
MFCD09475749
【English Synonyms】
【Formula】
C16 H13 Br N2
【MolWeight】
313.197
【Inchi】
InChI=1S/C16H13BrN2/c17-12-14-11-16(13-7-3-1-4-8-13)19(18-14)15-9-5-2-6-10-15/h1-11H,12H2
【InChIKey】
InChIKey=AWPOLAASHCZSOP-UHFFFAOYSA-N
【SMILES】
c1ccc(cc1)c2cc(nn2c3ccccc3)CBr
【MOL File】
3-BROMOMETHYL-N,5-DI….mol
2Chemical and Physical Properties
【Computed Properties】
H bond donor:0
H bond acceptor:2
XLogP3:4.0
Bulk/Fine:F
3Material Safety Data Sheet(MSDS)
4CML File
3-BROMOMETHYL-N,5-DIPHENYL-PYRAZOLE.cml