51153-62-9
(2R,5S)-REL-2,5-DIMETHYL-4-PIPERIDINONE
Name(2R,5S)-REL-2,5-DIMETHYL-4-PIPERIDINONE
1Identification
【Name】
(2R,5S)-REL-2,5-DIMETHYL-4-PIPERIDINONE
【CAS】
【MDL】
MFCD17677428
【English Synonyms】
【Formula】
C7 H13 N O
【MolWeight】
127.186
【Inchi】
InChI=1S/C7H13NO/c1-5-4-8-6(2)3-7(5)9/h5-6,8H,3-4H2,1-2H3/t5-,6+/m0/s1
【InChIKey】
InChIKey=KZAGJHDAWXVDQX-NTSWFWBYSA-N
【SMILES】
C[C@@H]1CC(=O)[C@H](CN1)C
【MOL File】
(2R,5S)-REL-2,5-DIME….mol
2Chemical and Physical Properties
【Computed Properties】
H bond donor:1
H bond acceptor:2
XLogP3:0.0
Bulk/Fine:F
3Material Safety Data Sheet(MSDS)
4CML File
(2R,5S)-REL-2,5-DIMETHYL-4-PIPERIDINONE.cml