272114-52-0
CYCLOHEXANONE, 2-FLUORO-2-METHYL-5-(1-METHYLETHYL)-, (2R,5R)-
NameCYCLOHEXANONE, 2-FLUORO-2-METHYL-5-(1-METHYLETHYL)-, (2R,5R)-
1Identification
【Name】
CYCLOHEXANONE, 2-FLUORO-2-METHYL-5-(1-METHYLETHYL)-, (2R,5R)-
【CAS】
【MDL】
MFCD18836099
【English Synonyms】
【Formula】
C10 H17 F O
【MolWeight】
172.241
【Inchi】
InChI=1S/C10H17FO/c1-7(2)8-4-5-10(3,11)9(12)6-8/h7-8H,4-6H2,1-3H3/t8-,10-/m1/s1
【InChIKey】
InChIKey=NGBYMFOAIMGBPC-PSASIEDQSA-N
【SMILES】
CC(C)[C@@H]1CC[C@@](C(=O)C1)(C)F
【MOL File】
CYCLOHEXANONE, 2-FLU….mol
2Chemical and Physical Properties
【Computed Properties】
H bond donor:0
H bond acceptor:1
XLogP3:2.0
Bulk/Fine:F
3Material Safety Data Sheet(MSDS)
4CML File
CYCLOHEXANONE, 2-FLUORO-2-METHYL-5-(1-METHYLETHYL)-, (2R,5R)-.cml