928708-26-3
METHYL 2-(4-(3-FORMYL-2,5-DIMETHYL-1H-PYRROL-1-YL)PHENYL)ACETATE
NameMETHYL 2-(4-(3-FORMYL-2,5-DIMETHYL-1H-PYRROL-1-YL)PHENYL)ACETATE
1Identification
【Name】
METHYL 2-(4-(3-FORMYL-2,5-DIMETHYL-1H-PYRROL-1-YL)PHENYL)ACETATE
【CAS】
【MDL】
MFCD08753648
【EnglishSynonyms】
【pro_formula】
C16 H17 N O3
【pro_molWeight】
271.314
【Inchi】
InChI=1S/C16H17NO3/c1-11-8-14(10-18)12(2)17(11)15-6-4-13(5-7-15)9-16(19)20-3/h4-8,10H,9H2,1-3H3
【InChIKey】
InChIKey=HXANJYAVBOKAHI-UHFFFAOYSA-N
【SMILES】
Cc1cc(c(n1c2ccc(cc2)CC(=O)OC)C)C=O
【MOL File】
METHYL 2-(4-(3-FORMY….mol
2ChemicalProperties
【ComputedProperties】
pro_donors:0
pro_acceptors:4
XLogP3:3.0
Bulk/Fine:F
3MaterialMSDS
4CMLFile
METHYL 2-(4-(3-FORMYL-2,5-DIMETHYL-1H-PYRROL-1-YL)PHENYL)ACETATE.cml