Nitric acid 2-ethyl-2-nitro-propanediyl ester
Basic information
- CAS
4153-96-2- Standard SMILES
CCC(CO[N+](=O)[O-])(CO[N+](=O)[O-])[N+](=O)[O-]- InChIKey
MDRCVOWCJOSPEW-UHFFFAOYSA-N- Molecular formula
- C5H9N3O8
- Average molar mass
- 239.14 g/mol
- Monoisotopic mass
- 239.03896425
Names & identifiers
- Preferred name
- Nitric acid 2-ethyl-2-nitro-propanediyl ester
- IUPAC
- [2-nitro-2-(nitrooxymethyl)butyl] nitrate
- English name
- 2-Ethyl-2-nitro-1,3-propanediol dinitrate
- Molecular formula
- C5H9N3O8
- Molecular weight
- 239.14026
Names & synonyms
SCHEMBL10949130nitric acid 2-ethyl-2-nitro-propanediyl ester2-Ethyl-2-nitro-1,3-propanediol dinitrate
Database identifiers
- CAS
4153-96-2- PubChem CID
- 54066971
Properties
Computed structural properties
- XLogP
- 1.3
- Topological polar surface area
- 156 Ų
- Hydrogen bond donors
- 0
- Hydrogen bond acceptors
- 8
- Rotatable bonds
- 5
- Heavy atoms
- 16
- Formal charge
- 0
- Complexity
- 257
Experimental & physicochemical properties
SpringerMaterials PropertiesViscosity
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