587842-30-6
BENZO[B]THIOPHENE-2-CARBOXYLIC ACID, 3-CHLORO-6-METHOXY-, 4-CHLORO-3-METHYLPHENYL ESTER
NameBENZO[B]THIOPHENE-2-CARBOXYLIC ACID, 3-CHLORO-6-METHOXY-, 4-CHLORO-3-METHYLPHENYL ESTER
1Identification
【Name】
BENZO[B]THIOPHENE-2-CARBOXYLIC ACID, 3-CHLORO-6-METHOXY-, 4-CHLORO-3-METHYLPHENYL ESTER
【CAS】
【MDL】
MFCD03628656
【English Synonyms】
【Formula】
C17 H12 Cl2 O3 S
【MolWeight】
367.251
【Inchi】
InChI=1S/C17H12Cl2O3S/c1-9-7-11(4-6-13(9)18)22-17(20)16-15(19)12-5-3-10(21-2)8-14(12)23-16/h3-8H,1-2H3
【InChIKey】
InChIKey=KBTIDHFVZLNFRP-UHFFFAOYSA-N
【SMILES】
Cc1cc(ccc1Cl)OC(=O)c2c(c3ccc(cc3s2)OC)Cl
【MOL File】
BENZO[B]THIOPHENE-2-….mol
2Chemical and Physical Properties
【Computed Properties】
H bond donor:0
H bond acceptor:3
XLogP3:5.0
Bulk/Fine:F
3Material Safety Data Sheet(MSDS)
4CML File
BENZO[B]THIOPHENE-2-CARBOXYLIC ACID, 3-CHLORO-6-METHOXY-, 4-CHLORO-3-METHYLPHENYL ESTER.cml