742118-86-1
2-CHLORO-1-(2,5-DIMETHYL-1-PHENYL-1H-PYRROL-3-YL)PROPAN-1-ONE
Name2-CHLORO-1-(2,5-DIMETHYL-1-PHENYL-1H-PYRROL-3-YL)PROPAN-1-ONE
1Identification
【Name】
2-CHLORO-1-(2,5-DIMETHYL-1-PHENYL-1H-PYRROL-3-YL)PROPAN-1-ONE
【CAS】
【MDL】
MFCD05261906
【English Synonyms】
【Formula】
C15 H16 Cl N O
【MolWeight】
261.75
【Inchi】
InChI=1S/C15H16ClNO/c1-10-9-14(15(18)11(2)16)12(3)17(10)13-7-5-4-6-8-13/h4-9,11H,1-3H3
【InChIKey】
InChIKey=JZNKVNMEXHKRJL-UHFFFAOYSA-N
【SMILES】
Cc1cc(c(n1c2ccccc2)C)C(=O)C(C)Cl
【MOL File】
2-CHLORO-1-(2,5-DIME….mol
2Chemical and Physical Properties
【Computed Properties】
H bond donor:0
H bond acceptor:2
XLogP3:4.0
Bulk/Fine:F
3Material Safety Data Sheet(MSDS)
4CML File
2-CHLORO-1-(2,5-DIMETHYL-1-PHENYL-1H-PYRROL-3-YL)PROPAN-1-ONE.cml