90212-81-0
([BIS(4-FLUOROPHENYL)METHYL]THIO)ACETIC ACID
Name([BIS(4-FLUOROPHENYL)METHYL]THIO)ACETIC ACID
1Identification
【Name】
([BIS(4-FLUOROPHENYL)METHYL]THIO)ACETIC ACID
【CAS】
【MDL】
MFCD05270835
【English Synonyms】
【Formula】
C15 H12 F2 O2 S
【MolWeight】
294.32
【Inchi】
InChI=1S/C15H12F2O2S/c16-12-5-1-10(2-6-12)15(20-9-14(18)19)11-3-7-13(17)8-4-11/h1-8,15H,9H2,(H,18,19)
【InChIKey】
InChIKey=AKBHXBCMSOZXPR-UHFFFAOYSA-N
【SMILES】
c1cc(ccc1C(c2ccc(cc2)F)SCC(=O)O)F
【MOL File】
([BIS(4-FLUOROPHENYL….mol
2Chemical and Physical Properties
【Computed Properties】
H bond donor:1
H bond acceptor:2
XLogP3:3.0
Bulk/Fine:F
3Material Safety Data Sheet(MSDS)
4CML File
([BIS(4-FLUOROPHENYL)METHYL]THIO)ACETIC ACID.cml