467-13-0
CODEINONE
Name
CODEINONE
Formula
C18 H19 N O3
MolWeight
297.352
1Identification
【Name】
CODEINONE
【CAS】
【MDL】
MFCD01714323
【English Synonyms】
【Formula】
C18 H19 N O3
【MolWeight】
297.352
【Inchi】
InChI=1S/C18H19NO3/c1-19-8-7-18-11-4-5-13(20)17(18)22-16-14(21-2)6-3-10(15(16)18)9-12(11)19/h3-6,11-12,17H,7-9H2,1-2H3/t11-,12+,17-,18-/m0/s1
【InChIKey】
InChIKey=XYYVYLMBEZUESM-CMKMFDCUSA-N
【SMILES】
CN1CC[C@]23c4c5ccc(c4O[C@H]2C(=O)C=C[C@H]3[C@H]1C5)OC
【MOL File】
2Chemical and Physical Properties
【Computed Properties】
H bond donor:0
H bond acceptor:4
XLogP3:2.0
Bulk/Fine:F
3Material Safety Data Sheet(MSDS)
4CML File
CODEINONE.cml
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