Bis-(2,2-dinitropropyl)acetal mixture with formal
Basic information
- CAS
80456-53-7- Standard SMILES
CC(COCOCC(C)([N+](=O)[O-])[N+](=O)[O-])([N+](=O)[O-])[N+](=O)[O-].CC(OCC(C)([N+](=O)[O-])[N+](=O)[O-])OCC(C)([N+](=O)[O-])[N+](=O)[O-]- InChIKey
LSLGCKBDVWXMSH-UHFFFAOYSA-N- Molecular formula
- C15H26N8O20
- Average molar mass
- 638.4 g/mol
- Monoisotopic mass
- 638.12633525
Names & identifiers
- Preferred name
- Bis-(2,2-dinitropropyl)acetal mixture with formal
- IUPAC
- 1-[1-(2,2-dinitropropoxy)ethoxy]-2,2-dinitropropane;1-(2,2-dinitropropoxymethoxy)-2,2-dinitropropane
Names & synonyms
80456-53-7RefChem:1079998NitroplasticizerBDNPA/FSCHEMBL29620670DTXSID501001250Propane, 1,1'-(ethylidenebis(oxy))bis(2,2-dinitro-, mixt. with 1,1'-(methylenebis(oxy))bis(2,2-dinitropropane)1-[(2,2-Dinitropropoxy)methoxy]-2,2-dinitropropane--1-[1-(2,2-dinitropropoxy)ethoxy]-2,2-dinitropropane (1/1)
Database identifiers
- CAS
80456-53-7- PubChem CID
- 157336
- DTXSID
DTXSID501001250
Properties
Computed structural properties
- Topological polar surface area
- 403 Ų
- Hydrogen bond donors
- 0
- Hydrogen bond acceptors
- 20
- Rotatable bonds
- 12
- Heavy atoms
- 43
- Formal charge
- 0
- Complexity
- 748
Related reactions
0 records
No reaction records under the current filter.
Compound notes
Loading…