51859-13-3
N-PICRYL-ALPHA,ALPHA,ALPHA-TRIFLUORO-M-TOLUIDINE
NameN-PICRYL-ALPHA,ALPHA,ALPHA-TRIFLUORO-M-TOLUIDINE
pro_formulaC13 H7 F3 N4 O6
1Identification
【Name】
N-PICRYL-ALPHA,ALPHA,ALPHA-TRIFLUORO-M-TOLUIDINE
【CAS】
【MDL】
MFCD00024441
【中文同义词】
【EnglishSynonyms】
【pro_formula】
C13 H7 F3 N4 O6
【pro_molWeight】
372.214
【Inchi】
InChI=1S/C13H7F3N4O6/c14-13(15,16)7-2-1-3-8(4-7)17-12-10(19(23)24)5-9(18(21)22)6-11(12)20(25)26/h1-6,17H
【InChIKey】
InChIKey=MJGBRCNTJMOLMM-UHFFFAOYSA-N
【SMILES】
c1cc(cc(c1)Nc2c(cc(cc2[N+](=O)[O-])[N+](=O)[O-])[N+](=O)[O-])C(F)(F)F
【MOL File】
N-PICRYL-ALPHA,ALPHA….mol
2ChemicalProperties
【ComputedProperties】
pro_donors:1
pro_acceptors:10
XLogP3:4.0
Bulk/Fine:F
3MaterialMSDS
4CMLFile
N-PICRYL-ALPHA,ALPHA,ALPHA-TRIFLUORO-M-TOLUIDINE.cml