352421-99-9
CYCLOPENTANONE, 3-HYDROXY-4-METHYL-2-(1-METHYLETHYLIDENE)-, (4S)-
NameCYCLOPENTANONE, 3-HYDROXY-4-METHYL-2-(1-METHYLETHYLIDENE)-, (4S)-
1Identification
【Name】
CYCLOPENTANONE, 3-HYDROXY-4-METHYL-2-(1-METHYLETHYLIDENE)-, (4S)-
【CAS】
【MDL】
MFCD18832311
【English Synonyms】
【Formula】
C9 H14 O2
【MolWeight】
154.208
【Inchi】
InChI=1S/C9H14O2/c1-5(2)8-7(10)4-6(3)9(8)11/h6,9,11H,4H2,1-3H3/t6-,9?/m0/s1
【InChIKey】
InChIKey=OTDORFDLNONSHW-AADKRJSRSA-N
【SMILES】
C[C@H]1CC(=O)C(=C(C)C)C1O
【MOL File】
CYCLOPENTANONE, 3-HY….mol
2Chemical and Physical Properties
【Computed Properties】
H bond donor:1
H bond acceptor:2
XLogP3:1.0
Bulk/Fine:F
3Material Safety Data Sheet(MSDS)
4CML File
CYCLOPENTANONE, 3-HYDROXY-4-METHYL-2-(1-METHYLETHYLIDENE)-, (4S)-.cml