179735-23-0
2-CYCLOHEXEN-1-ONE, 5-HYDROXY-2-METHYL-5-(1-METHYLETHYL)-, (5S)-
Name2-CYCLOHEXEN-1-ONE, 5-HYDROXY-2-METHYL-5-(1-METHYLETHYL)-, (5S)-
1Identification
【Name】
2-CYCLOHEXEN-1-ONE, 5-HYDROXY-2-METHYL-5-(1-METHYLETHYL)-, (5S)-
【CAS】
【MDL】
MFCD18832489
【English Synonyms】
【Formula】
C10 H16 O2
【MolWeight】
168.234
【Inchi】
InChI=1S/C10H16O2/c1-7(2)10(12)5-4-8(3)9(11)6-10/h4,7,12H,5-6H2,1-3H3/t10-/m0/s1
【InChIKey】
InChIKey=DGEWYWFAEONYKR-JTQLQIEISA-N
【SMILES】
CC1=CC[C@](CC1=O)(C(C)C)O
【MOL File】
2-CYCLOHEXEN-1-ONE, ….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
2-CYCLOHEXEN-1-ONE, 5-HYDROXY-2-METHYL-5-(1-METHYLETHYL)-, (5S)-.cml