885323-01-3
3-(3-BROMOPHENYL)CYCLOPENT-2-EN-1-ONE
Name3-(3-BROMOPHENYL)CYCLOPENT-2-EN-1-ONE
1Identification
【Name】
3-(3-BROMOPHENYL)CYCLOPENT-2-EN-1-ONE
【CAS】
【MDL】
MFCD09038044
【English Synonyms】
【Formula】
C11 H9 Br O
【MolWeight】
237.095
【Inchi】
InChI=1S/C11H9BrO/c12-10-3-1-2-8(6-10)9-4-5-11(13)7-9/h1-3,6-7H,4-5H2
【InChIKey】
InChIKey=YVWVXDNYUQMCDE-UHFFFAOYSA-N
【SMILES】
c1cc(cc(c1)Br)C2=CC(=O)CC2
【MOL File】
3-(3-BROMOPHENYL)CYC….mol
2Chemical and Physical Properties
【Computed Properties】
H bond donor:0
H bond acceptor:1
XLogP3:3.0
Bulk/Fine:F
3Material Safety Data Sheet(MSDS)
4CML File
3-(3-BROMOPHENYL)CYCLOPENT-2-EN-1-ONE.cml