Basic information
- CAS
505-63-5- Standard SMILES
C1CCOOCC1- InChIKey
HGGNZMUHOHGHBJ-UHFFFAOYSA-N- Molecular formula
- C5H10O2
- Average molar mass
- 102.13 g/mol
- Monoisotopic mass
- 102.06807956
Names & identifiers
- Preferred name
- 1,2-Dioxepane
- IUPAC
- dioxepane
Names & synonyms
1,2-Dioxepane505-63-5DTXSID30198520RefChem:216129DTXCID90121011dioxepaneSCHEMBL962656SCHEMBL1462228SCHEMBL1696769SCHEMBL4284256SCHEMBL85461993H-1,2-Dioxepin, tetrahydro-
Show more names
SCHEMBL15284632
Database identifiers
- CAS
505-63-5- PubChem CID
- 136336
- DTXSID
DTXSID30198520
Properties
Computed structural properties
- XLogP
- 1
- Topological polar surface area
- 18.5 Ų
- Hydrogen bond donors
- 0
- Hydrogen bond acceptors
- 2
- Rotatable bonds
- 0
- Heavy atoms
- 7
- Formal charge
- 0
- Complexity
- 39.3
Related reactions
0 records
No reaction records under the current filter.
Compound notes
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