852940-49-9
4-FLUORO-3-METHYL-1-BENZOTHIOPHENE-2-CARBOXYLIC ACID
Name4-FLUORO-3-METHYL-1-BENZOTHIOPHENE-2-CARBOXYLIC ACID
1Identification
【Name】
4-FLUORO-3-METHYL-1-BENZOTHIOPHENE-2-CARBOXYLIC ACID
【CAS】
【MDL】
MFCD06655826
【English Synonyms】
【Formula】
C10 H7 F O2 S
【MolWeight】
210.227
【Inchi】
InChI=1S/C10H7FO2S/c1-5-8-6(11)3-2-4-7(8)14-9(5)10(12)13/h2-4H,1H3,(H,12,13)
【InChIKey】
InChIKey=SLKHVQZFOWEYQS-UHFFFAOYSA-N
【SMILES】
Cc1c2c(cccc2sc1C(=O)O)F
【MOL File】
4-FLUORO-3-METHYL-1-….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
4-FLUORO-3-METHYL-1-BENZOTHIOPHENE-2-CARBOXYLIC ACID.cml