3-(2-Chloroethyl)-1,3-diazaspiro[4.5]decane-2,4-dione
Basic information
- CAS
53195-97-4- Standard SMILES
O=C1NC2(CCCCC2)C(=O)N1CCCl- InChIKey
BNSSNUHBZCULQA-UHFFFAOYSA-N- Molecular formula
- C10H15ClN2O2
- Average molar mass
- 230.69 g/mol
- Monoisotopic mass
- 230.0822054
Names & identifiers
- Preferred name
- 3-(2-Chloroethyl)-1,3-diazaspiro[4.5]decane-2,4-dione
- IUPAC
- 3-(2-chloroethyl)-1,3-diazaspiro[4.5]decane-2,4-dione
- English name
- 3-(2-chloroethyl)-1,3-diazaspiro[4.5]decane-2,4-dione
- Molecular formula
- C10H15ClN2O2
- Molecular weight
- 230.69
Names & synonyms
53195-97-43-(2-Chloroethyl)-1,3-diazaspiro[4.5]decane-2,4-dioneNSC169793SCHEMBL11648474DTXSID50305219NSC-1697931,3-Diazaspiro[4.5]decane-2,4-dione, 3-(2-chloroethyl)-
Database identifiers
- CAS
53195-97-4- PubChem CID
- 298087
- DTXSID
DTXSID50305219
Properties
Computed structural properties
- XLogP
- 1.3
- Topological polar surface area
- 49.4 Ų
- Hydrogen bond donors
- 1
- Hydrogen bond acceptors
- 2
- Rotatable bonds
- 2
- Heavy atoms
- 15
- Formal charge
- 0
- Complexity
- 287
Physicochemical properties
- Density
- 1.3 · 1.30±0.1 g/cm3(Predicted)
- pka
- 10.33 · 10.33±0.20(Predicted)
Related reactions
0 records
No reaction records under the current filter.
Compound notes
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