131505-63-0
2,6,7-TRIOXABICYCLO(2.2.2)OCTANE, 1-(4-ETHYNYLPHENYL)-4-(3-FLUOROPHENY L)-
Name2,6,7-TRIOXABICYCLO(2.2.2)OCTANE, 1-(4-ETHYNYLPHENYL)-4-(3-FLUOROPHENY L)-
1Identification
【Name】
2,6,7-TRIOXABICYCLO(2.2.2)OCTANE, 1-(4-ETHYNYLPHENYL)-4-(3-FLUOROPHENY L)-
【CAS】
【MDL】
MFCD01677681
【English Synonyms】
【Formula】
C19 H15 F O3
【MolWeight】
310.323
【Inchi】
InChI=1S/C19H15FO3/c1-2-14-6-8-15(9-7-14)19-21-11-18(12-22-19,13-23-19)16-4-3-5-17(20)10-16/h1,3-10H,11-13H2/t18-,19-
【InChIKey】
InChIKey=HAVKSOAZTDSJKS-WGSAOQKQSA-N
【SMILES】
C#Cc1ccc(cc1)[C@@]23OC[C@@](CO2)(CO3)c4cccc(c4)F
【MOL File】
2,6,7-TRIOXABICYCLO(….mol
2Chemical and Physical Properties
【Computed Properties】
H bond donor:0
H bond acceptor:3
XLogP3:4.0
Bulk/Fine:F
3Material Safety Data Sheet(MSDS)
4CML File
2,6,7-TRIOXABICYCLO(2.2.2)OCTANE, 1-(4-ETHYNYLPHENYL)-4-(3-FLUOROPHENY L)-.cml