Basic information
- CAS
36235-44-6- Standard SMILES
CCOC(=O)CN1CC([N+](=O)[O-])([N+](=O)[O-])CC([N+](=O)[O-])([N+](=O)[O-])C1- InChIKey
ZXCVPZBCADFNPO-UHFFFAOYSA-N- Molecular formula
- C9H13N5O10
- Average molar mass
- 351.23 g/mol
- Monoisotopic mass
- 351.06624163
Names & identifiers
- Preferred name
- Ethyl 2-(3,3,5,5-tetranitropiperidin-1-yl)acetate
- IUPAC
- ethyl 2-(3,3,5,5-tetranitropiperidin-1-yl)acetate
Names & synonyms
36235-44-6NSC126736DTXSID60957622NSC-126736Ethyl (3,3,5,5-tetranitropiperidin-1-yl)acetate
Database identifiers
- CAS
36235-44-6- PubChem CID
- 277751
- DTXSID
DTXSID60957622
Properties
Computed structural properties
- XLogP
- 0.1
- Topological polar surface area
- 213 Ų
- Hydrogen bond donors
- 0
- Hydrogen bond acceptors
- 11
- Rotatable bonds
- 4
- Heavy atoms
- 24
- Formal charge
- 0
- Complexity
- 501
Related reactions
0 records
No reaction records under the current filter.
Compound notes
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