191332-14-6
4-FLUORO-ALPHA-(1-METHYLETHYL)-BENZENEACETIC ACID, ETHYL ESTER
Name4-FLUORO-ALPHA-(1-METHYLETHYL)-BENZENEACETIC ACID, ETHYL ESTER
1Identification
【Name】
4-FLUORO-ALPHA-(1-METHYLETHYL)-BENZENEACETIC ACID, ETHYL ESTER
【CAS】
【MDL】
MFCD16756805
【English Synonyms】
【Formula】
C13 H17 F O2
【MolWeight】
224.273
【Inchi】
InChI=1S/C13H17FO2/c1-4-16-13(15)12(9(2)3)10-5-7-11(14)8-6-10/h5-9,12H,4H2,1-3H3
【InChIKey】
InChIKey=VVPWURZURLTWNK-UHFFFAOYSA-N
【SMILES】
CCOC(=O)C(c1ccc(cc1)F)C(C)C
【MOL File】
4-FLUORO-ALPHA-(1-ME….mol
2Chemical and Physical Properties
【Computed Properties】
H bond donor:0
H bond acceptor:2
XLogP3:4.0
Bulk/Fine:F
3Material Safety Data Sheet(MSDS)
4CML File
4-FLUORO-ALPHA-(1-METHYLETHYL)-BENZENEACETIC ACID, ETHYL ESTER.cml