590347-63-0
4-CHLORO-2-(5-ETHYLTHIOPHEN-2-YL)-7-METHYL-1H-INDOLE-3-CARBALDEHYDE
Name4-CHLORO-2-(5-ETHYLTHIOPHEN-2-YL)-7-METHYL-1H-INDOLE-3-CARBALDEHYDE
1Identification
【Name】
4-CHLORO-2-(5-ETHYLTHIOPHEN-2-YL)-7-METHYL-1H-INDOLE-3-CARBALDEHYDE
【CAS】
【MDL】
MFCD05180788
【English Synonyms】
【Formula】
C16 H14 Cl N O S
【MolWeight】
303.812
【Inchi】
InChI=1S/C16H14ClNOS/c1-3-10-5-7-13(20-10)16-11(8-19)14-12(17)6-4-9(2)15(14)18-16/h4-8,18H,3H2,1-2H3
【InChIKey】
InChIKey=HANVIKVMPIPNBC-UHFFFAOYSA-N
【SMILES】
CCc1ccc(s1)c2c(c3c(ccc(c3[nH]2)C)Cl)C=O
【MOL File】
4-CHLORO-2-(5-ETHYLT….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
4-CHLORO-2-(5-ETHYLTHIOPHEN-2-YL)-7-METHYL-1H-INDOLE-3-CARBALDEHYDE.cml