587827-04-1
2-(5-CHLOROTHIOPHEN-2-YL)-4,6-DIMETHYL-1H-INDOLE-3-CARBALDEHYDE
Name2-(5-CHLOROTHIOPHEN-2-YL)-4,6-DIMETHYL-1H-INDOLE-3-CARBALDEHYDE
1Identification
【Name】
2-(5-CHLOROTHIOPHEN-2-YL)-4,6-DIMETHYL-1H-INDOLE-3-CARBALDEHYDE
【CAS】
【MDL】
MFCD05180227
【English Synonyms】
【Formula】
C15 H12 Cl N O S
【MolWeight】
289.785
【Inchi】
InChI=1S/C15H12ClNOS/c1-8-5-9(2)14-10(7-18)15(17-11(14)6-8)12-3-4-13(16)19-12/h3-7,17H,1-2H3
【InChIKey】
InChIKey=VSRVISGZEITDKU-UHFFFAOYSA-N
【SMILES】
Cc1cc(c2c(c1)[nH]c(c2C=O)c3ccc(s3)Cl)C
【MOL File】
2-(5-CHLOROTHIOPHEN-….mol
2Chemical and Physical Properties
【Computed Properties】
H bond donor:1
H bond acceptor:2
XLogP3:5.0
Bulk/Fine:F
3Material Safety Data Sheet(MSDS)
4CML File
2-(5-CHLOROTHIOPHEN-2-YL)-4,6-DIMETHYL-1H-INDOLE-3-CARBALDEHYDE.cml