2-ethoxy-2-methyl-6,7-bis(phenylmethoxy)-5-(phenylmethoxymethyl)-5,6,7,7a-tetrahydro-3aH-[1,3]dioxolo[4,5-b]pyran
Basic information
- CAS
32860-96-1- Standard SMILES
CCOC1(C)OC2OC(COCc3ccccc3)C(OCc3ccccc3)C(OCc3ccccc3)C2O1- InChIKey
HWTIKERIIAXGDZ-UHFFFAOYSA-N- Molecular formula
- C31H36O7
- Average molar mass
- 520.6 g/mol
- Monoisotopic mass
- 520.24610348
Names & identifiers
- Preferred name
- 2-ethoxy-2-methyl-6,7-bis(phenylmethoxy)-5-(phenylmethoxymethyl)-5,6,7,7a-tetrahydro-3aH-[1,3]dioxolo[4,5-b]pyran
- IUPAC
- 2-ethoxy-2-methyl-6,7-bis(phenylmethoxy)-5-(phenylmethoxymethyl)-5,6,7,7a-tetrahydro-3aH-[1,3]dioxolo[4,5-b]pyran
Names & synonyms
32860-96-1NSC2723572-ethoxy-2-methyl-6,7-bis(phenylmethoxy)-5-(phenylmethoxymethyl)-5,6,7,7a-tetrahydro-3aH-[1,3]dioxolo[4,5-b]pyranSCHEMBL10262538DTXSID70330543NSC-2723573,4,6-Tri-O-benzyl-1,2-O-(1-ethoxyethylidene)hexopyranose
Database identifiers
- CAS
32860-96-1- PubChem CID
- 430359
- DTXSID
DTXSID70330543
Properties
Computed structural properties
- XLogP
- 4.5
- Topological polar surface area
- 64.6 Ų
- Hydrogen bond donors
- 0
- Hydrogen bond acceptors
- 7
- Rotatable bonds
- 12
- Heavy atoms
- 38
- Formal charge
- 0
- Complexity
- 673
Related reactions
0 records
No reaction records under the current filter.
Compound notes
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