570-04-7
2,5-DIMETHYL-1-(3-TRIFLUOROMETHYL-PHENYL)-1H-PYRROLE
Name2,5-DIMETHYL-1-(3-TRIFLUOROMETHYL-PHENYL)-1H-PYRROLE
1Identification
【Name】
2,5-DIMETHYL-1-(3-TRIFLUOROMETHYL-PHENYL)-1H-PYRROLE
【CAS】
【MDL】
MFCD03228549
【English Synonyms】
【Formula】
C13 H12 F3 N
【MolWeight】
239.239
【Inchi】
InChI=1S/C13H12F3N/c1-9-6-7-10(2)17(9)12-5-3-4-11(8-12)13(14,15)16/h3-8H,1-2H3
【InChIKey】
InChIKey=DVPGIUYXJKUREU-UHFFFAOYSA-N
【SMILES】
Cc1ccc(n1c2cccc(c2)C(F)(F)F)C
【MOL File】
2,5-DIMETHYL-1-(3-TR….mol
2Chemical and Physical Properties
【Computed Properties】
H bond donor:0
H bond acceptor:1
XLogP3:4.0
Bulk/Fine:F
3Material Safety Data Sheet(MSDS)
4CML File
2,5-DIMETHYL-1-(3-TRIFLUOROMETHYL-PHENYL)-1H-PYRROLE.cml