587827-49-4
6-CHLORO-7-METHYL-2-(5-METHYLTHIOPHEN-2-YL)-1H-INDOLE-3-CARBALDEHYDE
Name6-CHLORO-7-METHYL-2-(5-METHYLTHIOPHEN-2-YL)-1H-INDOLE-3-CARBALDEHYDE
1Identification
【Name】
6-CHLORO-7-METHYL-2-(5-METHYLTHIOPHEN-2-YL)-1H-INDOLE-3-CARBALDEHYDE
【CAS】
【MDL】
MFCD05180272
【English Synonyms】
【Formula】
C15 H12 Cl N O S
【MolWeight】
289.785
【Inchi】
InChI=1S/C15H12ClNOS/c1-8-3-6-13(19-8)15-11(7-18)10-4-5-12(16)9(2)14(10)17-15/h3-7,17H,1-2H3
【InChIKey】
InChIKey=WYRQWNSTBPQMKI-UHFFFAOYSA-N
【SMILES】
Cc1ccc(s1)c2c(c3ccc(c(c3[nH]2)C)Cl)C=O
【MOL File】
6-CHLORO-7-METHYL-2-….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
6-CHLORO-7-METHYL-2-(5-METHYLTHIOPHEN-2-YL)-1H-INDOLE-3-CARBALDEHYDE.cml