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76779-67-4

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76779-67-4 Structure

76779-67-4 Structure
IdentificationBack Directory
[Name]

1,2:5,6-DI-O-CYCLOHEXYLIDENE-D-MANNITOL
[CAS]

76779-67-4
[Synonyms]

1,2:5,6-DI-O-CYCLOHEXYLIDENE-D-MANNITOL
D-Mannitol, 1,2:5,6-di-O-cyclohexylidene-
(1S,2S)-1,2-di((R)-1,4-dioxaspiro[4.5]decan-2-yl)ethane-1,2-diol
[Molecular Formula]

C18H30O6
[MDL Number]

MFCD09863049
[MOL File]

76779-67-4.mol
[Molecular Weight]

342.43
Chemical PropertiesBack Directory
[Melting point ]

103-105 °C(lit.)
[Boiling point ]

525.9±40.0 °C(Predicted)
[density ]

1.25±0.1 g/cm3(Predicted)
[pka]

12.99±0.20(Predicted)
[Optical Rotation]

[α]20/D +5.8°, c = 3 in methylene chloride
[BRN ]

4235336
[InChI]

1S/C18H30O6/c19-15(13-11-21-17(23-13)7-3-1-4-8-17)16(20)14-12-22-18(24-14)9-5-2-6-10-18/h13-16,19-20H,1-12H2/t13-,14-,15-,16-/m1/s1
[InChIKey]

DFWHMBZZFDLOTN-KLHDSHLOSA-N
[SMILES]

O[C@@H]([C@H](O)[C@H]1COC2(CCCCC2)O1)[C@H]3COC4(CCCCC4)O3
Safety DataBack Directory
[WGK Germany ]

3
[Storage Class]

11 - Combustible Solids
Spectrum DetailBack Directory
[Spectrum Detail]

1,2:5,6-DI-O-CYCLOHEXYLIDENE-D-MANNITOL(76779-67-4)Raman
1,2:5,6-DI-O-CYCLOHEXYLIDENE-D-MANNITOL(76779-67-4)IR
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