Basic information
- CAS
7464-32-6- Standard SMILES
CC1OCOC1C1OCOCC1OC(=O)c1ccccc1- InChIKey
OBMAFXYXYHBWLG-UHFFFAOYSA-N- Molecular formula
- C15H18O6
- Average molar mass
- 294.3 g/mol
- Monoisotopic mass
- 294.11033829
Names & identifiers
- Preferred name
- [4-(5-Methyl-1,3-dioxolan-4-yl)-1,3-dioxan-5-yl] benzoate
- IUPAC
- [4-(5-methyl-1,3-dioxolan-4-yl)-1,3-dioxan-5-yl] benzoate
Names & synonyms
7464-32-6NSC403968[4-(5-methyl-1,3-dioxolan-4-yl)-1,3-dioxan-5-yl] benzoateDTXSID90323417NSC-4039684-(5-METHYL-1,3-DIOXOLAN-4-YL)-1,3-DIOXAN-5-YL BENZOATE
Database identifiers
- CAS
7464-32-6- PubChem CID
- 345982
- DTXSID
DTXSID90323417
Properties
Computed structural properties
- XLogP
- 1.6
- Topological polar surface area
- 63.2 Ų
- Hydrogen bond donors
- 0
- Hydrogen bond acceptors
- 6
- Rotatable bonds
- 4
- Heavy atoms
- 21
- Formal charge
- 0
- Complexity
- 354
Related reactions
0 records
No reaction records under the current filter.
Compound notes
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