937732-38-2
(3-BROMO-5-FLUOROPHENYL)ACETIC ACID METHYL ESTER
Name(3-BROMO-5-FLUOROPHENYL)ACETIC ACID METHYL ESTER
1Identification
【Name】
(3-BROMO-5-FLUOROPHENYL)ACETIC ACID METHYL ESTER
【CAS】
【MDL】
MFCD20489056
【English Synonyms】
【Formula】
C9 H8 Br F O2
【MolWeight】
247.062
【Inchi】
InChI=1S/C9H8BrFO2/c1-13-9(12)4-6-2-7(10)5-8(11)3-6/h2-3,5H,4H2,1H3
【InChIKey】
InChIKey=AJSCFDHWZUZCNE-UHFFFAOYSA-N
【SMILES】
COC(=O)Cc1cc(cc(c1)Br)F
【MOL File】
(3-BROMO-5-FLUOROPHE….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
(3-BROMO-5-FLUOROPHENYL)ACETIC ACID METHYL ESTER.cml