70262-59-8
3-CHLORO-5,6-DIMETHOXY-BENZO[B]THIOPHENE-2-CARBONITRILE
Name3-CHLORO-5,6-DIMETHOXY-BENZO[B]THIOPHENE-2-CARBONITRILE
1Identification
【Name】
3-CHLORO-5,6-DIMETHOXY-BENZO[B]THIOPHENE-2-CARBONITRILE
【CAS】
【MDL】
MFCD13181018
【English Synonyms】
【Formula】
C11H8ClNO2S
【MolWeight】
253.708
【Inchi】
InChI=1S/C11H8ClNO2S/c1-14-7-3-6-9(4-8(7)15-2)16-10(5-13)11(6)12/h3-4H,1-2H3
【InChIKey】
InChIKey=SFZNNEPUWXVILO-UHFFFAOYSA-N
【SMILES】
ClC=1C2=C(SC1C#N)C=C(C(=C2)OC)OC
【MOL File】
3-CHLORO-5,6-DIMETHO….mol
2Chemical and Physical Properties
【Computed Properties】
H bond donor:0
H bond acceptor:3
XLogP3:2.8257
Bulk/Fine:F
3Material Safety Data Sheet(MSDS)
4CML File
3-CHLORO-5,6-DIMETHOXY-BENZO[B]THIOPHENE-2-CARBONITRILE.cml