(3aS,4R,6R,7R,7aR)-6-methoxy-2,2-dimethyl-4-(trityloxymethyl)-4,6,7,7a-tetrahydro-3aH-[1,3]dioxolo[4,5-c]pyran-7-ol
Basic information
- CAS
34698-24-3- Standard SMILES
CO[C@@H]1O[C@H](COC(c2ccccc2)(c2ccccc2)c2ccccc2)[C@@H]2OC(C)(C)O[C@@H]2[C@H]1O- InChIKey
XRRQNVSMIVDBQX-IURCNINISA-N- Molecular formula
- C29H32O6
- Average molar mass
- 476.6 g/mol
Names & identifiers
- Preferred name
- (3aS,4R,6R,7R,7aR)-6-methoxy-2,2-dimethyl-4-(trityloxymethyl)-4,6,7,7a-tetrahydro-3aH-[1,3]dioxolo[4,5-c]pyran-7-ol
- IUPAC
- (3aS,4R,6R,7R,7aR)-6-methoxy-2,2-dimethyl-4-(trityloxymethyl)-4,6,7,7a-tetrahydro-3aH-[1,3]dioxolo[4,5-c]pyran-7-ol
- English name
- Methyl-3,4-O-isopropylidene-6-O-triphenylmethyl-beta-D-galactopyranoside
- Molecular formula
- C29H32O6
- Molecular weight
- 476.56
Names & synonyms
34698-24-3METHYL-3,4-O-ISOPROPYLIDENE-6-O-TRIPHENYLMETHYL-SS-D-GALACTOPYRANOSIDEMethyl-3,4-O-isopropylidene-6-O-triphenylmethyl-beta-D-galactopyranosideβ-D-Galactopyranoside, methyl 3,4-O-(1-methylethylidene)-6-O-(triphenylmethyl)-
Database identifiers
- CAS
34698-24-3
Properties
Computed structural properties
- XLogP
- 4.2
- Topological polar surface area
- 66.4 Ų
- Hydrogen bond donors
- 1
- Hydrogen bond acceptors
- 6
- Rotatable bonds
- 7
- Heavy atoms
- 35
- Formal charge
- 0
- Complexity
- 619
Physicochemical properties
- Boiling point
- 600.8 · 600.8±55.0 °C(Predicted)
- Density
- 1.24 · 1.24±0.1 g/cm3(Predicted)
- pka
- 12.68 · 12.68±0.70(Predicted)
Related reactions
0 records
No reaction records under the current filter.
Compound notes
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