97649-89-3
2,3,4,5,6-PENTAFLUORO-BENZOIC ACID, PROPYL ESTER
Name2,3,4,5,6-PENTAFLUORO-BENZOIC ACID, PROPYL ESTER
1Identification
【Name】
2,3,4,5,6-PENTAFLUORO-BENZOIC ACID, PROPYL ESTER
【CAS】
【MDL】
MFCD12087064
【English Synonyms】
【Formula】
C10 H7 F5 O2
【MolWeight】
254.153
【Inchi】
InChI=1S/C10H7F5O2/c1-2-3-17-10(16)4-5(11)7(13)9(15)8(14)6(4)12/h2-3H2,1H3
【InChIKey】
InChIKey=QZYJMLLSDNHSOD-UHFFFAOYSA-N
【SMILES】
CCCOC(=O)c1c(c(c(c(c1F)F)F)F)F
【MOL File】
2,3,4,5,6-PENTAFLUOR….mol
2Chemical and Physical Properties
【Computed Properties】
H bond donor:0
H bond acceptor:2
XLogP3:3.0
Bulk/Fine:F
3Material Safety Data Sheet(MSDS)
4CML File
2,3,4,5,6-PENTAFLUORO-BENZOIC ACID, PROPYL ESTER.cml