306936-29-8
ETHYL 4-(CHLOROSULFONYL)-2-METHYL-1,5-DIPHENYL-1H-PYRROLE-3-CARBOXYLATE
NameETHYL 4-(CHLOROSULFONYL)-2-METHYL-1,5-DIPHENYL-1H-PYRROLE-3-CARBOXYLATE
1Identification
【Name】
ETHYL 4-(CHLOROSULFONYL)-2-METHYL-1,5-DIPHENYL-1H-PYRROLE-3-CARBOXYLATE
【CAS】
【MDL】
MFCD01934799
【English Synonyms】
【Formula】
C20 H18 Cl N O4 S
【MolWeight】
403.884
【Inchi】
InChI=1S/C20H18ClNO4S/c1-3-26-20(23)17-14(2)22(16-12-8-5-9-13-16)18(19(17)27(21,24)25)15-10-6-4-7-11-15/h4-13H,3H2,1-2H3
【InChIKey】
InChIKey=BGXKUQAVHZRWHU-UHFFFAOYSA-N
【SMILES】
CCOC(=O)c1c(n(c(c1S(=O)(=O)Cl)c2ccccc2)c3ccccc3)C
【MOL File】
ETHYL 4-(CHLOROSULFO….mol
2Chemical and Physical Properties
【Computed Properties】
H bond donor:0
H bond acceptor:5
XLogP3:6.0
Bulk/Fine:F
3Material Safety Data Sheet(MSDS)
4CML File
ETHYL 4-(CHLOROSULFONYL)-2-METHYL-1,5-DIPHENYL-1H-PYRROLE-3-CARBOXYLATE.cml