| Identification | Back Directory | [Name]
10-Methoxy-6-methylergoline-8β-carboxylic acid methyl ester | [CAS]
23495-64-9 | [Synonyms]
10α-methoxy-9,10-dihydrolysergic acid methylester
0-Methoxy-6-methylergoline-8β-carboxylic acid methyl ester
10-Methoxy-6-methylergoline-8β-carboxylic acid methyl ester
Ergoline-8-carboxylic acid, 10-methoxy-6-methyl-, methyl ester, (8β)- | [EINECS(EC#)]
607-239-5 | [Molecular Formula]
C18H22N2O3 | [MOL File]
23495-64-9.mol | [Molecular Weight]
314.39 |
| Chemical Properties | Back Directory | [Melting point ]
182-184 °C | [Boiling point ]
466.6±45.0 °C(Predicted) | [density ]
1.27±0.1 g/cm3(Predicted) | [vapor pressure ]
0Pa at 20℃ | [pka]
16.82±0.60(Predicted) | [Water Solubility ]
744mg/L at 20℃ | [InChI]
InChI=1/C18H22N2O3/c1-20-10-12(17(21)22-2)8-18(23-3)13-5-4-6-14-16(13)11(9-19-14)7-15(18)20/h4-6,9,12,15,19H,7-8,10H2,1-3H3/t12-,15-,18+/s3 | [InChIKey]
SCWPBCNOFOVVGZ-JXZGFAAWNA-N | [SMILES]
O([C@]12C[C@@H](C(=O)OC)CN(C)[C@]1([H])CC1=CNC3=CC=CC2=C13)C |&1:1,3,11,r| | [LogP]
3.1 |
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