4,7-Dimethyl-1,4,7-oxadiazecan-9-ol
Basic information
- CAS
138588-46-2- Standard SMILES
CN1CCOCC(O)CN(C)CC1- InChIKey
XWLXIEBYRHVFIS-UHFFFAOYSA-N- Molecular formula
- C9H20N2O2
- Average molar mass
- 188.27 g/mol
- Monoisotopic mass
- 188.15247789
Names & identifiers
- Preferred name
- 4,7-Dimethyl-1,4,7-oxadiazecan-9-ol
- IUPAC
- 4,7-dimethyl-1,4,7-oxadiazecan-9-ol
Names & synonyms
138588-46-24,7-Dimethyl-1,4,7-oxadiazecan-9-olDTXSID90577034
Database identifiers
- CAS
138588-46-2- PubChem CID
- 15700677
- DTXSID
DTXSID90577034
Properties
Computed structural properties
- XLogP
- -0.7
- Topological polar surface area
- 35.9 Ų
- Hydrogen bond donors
- 1
- Hydrogen bond acceptors
- 4
- Rotatable bonds
- 0
- Heavy atoms
- 13
- Formal charge
- 0
- Complexity
- 144
Related reactions
0 records
No reaction records under the current filter.
Compound notes
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