86792-78-1
3-BROMO-2-METHYL-BENZO[B]THIOPHENE-5-CARBOXYLIC ACID METHYL ESTER
Name3-BROMO-2-METHYL-BENZO[B]THIOPHENE-5-CARBOXYLIC ACID METHYL ESTER
1Identification
【Name】
3-BROMO-2-METHYL-BENZO[B]THIOPHENE-5-CARBOXYLIC ACID METHYL ESTER
【CAS】
【MDL】
MFCD16657673
【English Synonyms】
【Formula】
C11 H9 Br O2 S
【MolWeight】
285.16
【Inchi】
InChI=1S/C11H9BrO2S/c1-6-10(12)8-5-7(11(13)14-2)3-4-9(8)15-6/h3-5H,1-2H3
【InChIKey】
InChIKey=CSUDELIOELENPC-UHFFFAOYSA-N
【SMILES】
Cc1c(c2cc(ccc2s1)C(=O)OC)Br
【MOL File】
3-BROMO-2-METHYL-BEN….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
3-BROMO-2-METHYL-BENZO[B]THIOPHENE-5-CARBOXYLIC ACID METHYL ESTER.cml