512178-16-4
2H-PYRROL-2-ONE, 4-ACETYL-5-CYCLOHEXYL-1,5-DIHYDRO-3-HYDROXY-1-(4-METHYLPHENYL)-, (5S)-
Name
2H-PYRROL-2-ONE, 4-ACETYL-5-CYCLOHEXYL-1,5-DIHYDRO-3-HYDROXY-1-(4-METHYLPHENYL)-, (5S)-
Formula
C19 H23 N O3
MolWeight
313.395
1Identification
【Name】
2H-PYRROL-2-ONE, 4-ACETYL-5-CYCLOHEXYL-1,5-DIHYDRO-3-HYDROXY-1-(4-METHYLPHENYL)-, (5S)-
【CAS】
【MDL】
MFCD11616179
【English Synonyms】
【Formula】
C19 H23 N O3
【MolWeight】
313.395
【Inchi】
InChI=1S/C19H23NO3/c1-12-8-10-15(11-9-12)20-17(14-6-4-3-5-7-14)16(13(2)21)18(22)19(20)23/h8-11,14,17,22H,3-7H2,1-2H3/t17-/m0/s1
【InChIKey】
InChIKey=GKYSYXOYQGXXJB-KRWDZBQOSA-N
【SMILES】
Cc1ccc(cc1)N2[C@H](C(=C(C2=O)O)C(=O)C)C3CCCCC3
【MOL File】
2Chemical and Physical Properties
【Computed Properties】
H bond donor:1
H bond acceptor:4
XLogP3:3.0
Bulk/Fine:F
3Material Safety Data Sheet(MSDS)
4CML File
2H-PYRROL-2-ONE, 4-ACETYL-5-CYCLOHEXYL-1,5-DIHYDRO-3-HYDROXY-1-(4-METHYLPHENYL)-, (5S)-.cml
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