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80681-42-1

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80681-42-1 Structure

80681-42-1 Structure
IdentificationBack Directory
[Name]

5-O-METHYLVISAMMINOL
[CAS]

80681-42-1
[Synonyms]

5-O-METHYLVISAMMINOL
(S)-(+)-5-O-methylvisamminol
(S)-2,3-Dihydro-2-(1-hydroxy-1-methylethyl)-4-methoxy-7-methyl-5H-furo[3,2-g][1]benzopyran-5-one
5H-Furo[3,2-g][1]benzopyran-5-one, 2,3-dihydro-2-(1-hydroxy-1-methylethyl)-4-methoxy-7-methyl-, (2S)-
[Molecular Formula]

C16H18O5
[MDL Number]

MFCD09037392
[MOL File]

80681-42-1.mol
[Molecular Weight]

290.31
Chemical PropertiesBack Directory
[Melting point ]

133-135℃
[Boiling point ]

480.6±45.0 °C(Predicted)
[density ]

1.281±0.06 g/cm3(Predicted)
[storage temp. ]

2-8°C
[form ]

Solid
[pka]

14.25±0.29(Predicted)
[color ]

Light yellow to yellow
[Major Application]

food and beverages
[InChI]

1S/C16H18O5/c1-8-5-10(17)14-12(20-8)7-11-9(15(14)19-4)6-13(21-11)16(2,3)18/h5,7,13,18H,6H2,1-4H3/t13-/m0/s1
[InChIKey]

DGFLRNOCLJGHLY-ZDUSSCGKSA-N
[SMILES]

[o]1c2c([c](cc1C)=O)c(c3c(c2)O[C@@H](C3)C(O)(C)C)OC
Safety DataBack Directory
[WGK Germany ]

WGK 3
[Storage Class]

11 - Combustible Solids
Hazard InformationBack Directory
[Uses]

food and beverages
[Definition]

ChEBI: 5-O-Methylvisamminol is an oxacycle and an organic heterotricyclic compound.
Spectrum DetailBack Directory
[Spectrum Detail]

5-O-METHYLVISAMMINOL(80681-42-1)1HNMR
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