55706-04-2
7-(TRIFLUOROMETHYL)-9H-CARBAZOLE-1-CARBOXYLIC ACID
Name7-(TRIFLUOROMETHYL)-9H-CARBAZOLE-1-CARBOXYLIC ACID
1Identification
【Name】
7-(TRIFLUOROMETHYL)-9H-CARBAZOLE-1-CARBOXYLIC ACID
【CAS】
【MDL】
MFCD18823151
【English Synonyms】
【Formula】
C14 H8 F3 N O2
【MolWeight】
279.216
【Inchi】
InChI=1S/C14H8F3NO2/c15-14(16,17)7-4-5-8-9-2-1-3-10(13(19)20)12(9)18-11(8)6-7/h1-6,18H,(H,19,20)
【InChIKey】
InChIKey=QCUWTQJPHBASTO-UHFFFAOYSA-N
【SMILES】
c1cc2c3ccc(cc3[nH]c2c(c1)C(=O)O)C(F)(F)F
【MOL File】
7-(TRIFLUOROMETHYL)-….mol
2Chemical and Physical Properties
【Computed Properties】
H bond donor:2
H bond acceptor:3
XLogP3:4.0
Bulk/Fine:F
3Material Safety Data Sheet(MSDS)
4CML File
7-(TRIFLUOROMETHYL)-9H-CARBAZOLE-1-CARBOXYLIC ACID.cml