727705-98-8
2-CHLORO-1-(2,5-DIMETHYL-1-PROPYL-1H-PYRROL-3-YL)-ETHANONE
Name2-CHLORO-1-(2,5-DIMETHYL-1-PROPYL-1H-PYRROL-3-YL)-ETHANONE
1Identification
【Name】
2-CHLORO-1-(2,5-DIMETHYL-1-PROPYL-1H-PYRROL-3-YL)-ETHANONE
【CAS】
【MDL】
MFCD04618251
【English Synonyms】
【Formula】
C11 H16 Cl N O
【MolWeight】
213.706
【Inchi】
InChI=1S/C11H16ClNO/c1-4-5-13-8(2)6-10(9(13)3)11(14)7-12/h6H,4-5,7H2,1-3H3
【InChIKey】
InChIKey=KJLXGGVVFXBMOK-UHFFFAOYSA-N
【SMILES】
CCCn1c(cc(c1C)C(=O)CCl)C
【MOL File】
2-CHLORO-1-(2,5-DIME….mol
2Chemical and Physical Properties
【Computed Properties】
H bond donor:0
H bond acceptor:2
XLogP3:3.0
Bulk/Fine:F
3Material Safety Data Sheet(MSDS)
4CML File
2-CHLORO-1-(2,5-DIMETHYL-1-PROPYL-1H-PYRROL-3-YL)-ETHANONE.cml