Basic information
- CAS
4185-47-1- Standard SMILES
O=[N+]([O-])OCCN(CCO[N+](=O)[O-])[N+](=O)[O-]- InChIKey
NZDNCDGEHXHPCO-UHFFFAOYSA-N- Molecular formula
- C4H8N4O8
- Average molar mass
- 240.13 g/mol
- Monoisotopic mass
- 240.03421323
Names & identifiers
- Preferred name
- Diethanolnitramine dinitrate
- IUPAC
- 2-[nitro(2-nitrooxyethyl)amino]ethyl nitrate
- English name
- 2,2'-(Nitroimino)bisethanol dinitrate
- Molecular formula
- C4H8N4O8
- Molecular weight
- 240.13
Names & synonyms
Diethanolnitramine dinitrate4185-47-1DINA (explosive)BRN 1803252Ethanol, 2,2'-(nitroimino)bis-, dinitrate (ester)2,2'-(Nitroimino)bisethanol dinitrate (ester)Ethanol, 2,2'-nitroiminodi-, dinitrateN-Nitrobis(2-hydroxyethyl)-amine dinitrateDTXSID301946482,2'-Nitroiminobis(ethyl nitrate)4-04-00-03414 (Beilstein Handbook Reference)ETHANOL, 2,2'-NITROIMINODI-, DINITRATE (ester)
Show more names
2,2'-DinitroxydiethylnitamineBis[2-(nitrooxy)ethyl]nitroamine2,2'-(Nitroimino)bisethanol dinitrate2,2'-(Nitroimino)bis(ethanol nitrate)Dinitric acid 2,2'-(nitroimino)bisethyl esterEthanol, 2,2'-(nitroimino)bis-, 1,1'-dinitrate
Ethanol, 2,2'-(nitroimino)bis-, dinitrate (ester) (9CI)Ethanol, 2,2'-(nitroimino)bis-, dinitrateRefChem:337549DTXCID70117139NZDNCDGEHXHPCO-UHFFFAOYSA-NDINANitrodiethanolamine dinitratesym-Dinitroxydiethylnitramine
Database identifiers
Properties
Computed structural properties
- XLogP
- 1.2
- Topological polar surface area
- 159 Ų
- Hydrogen bond donors
- 0
- Hydrogen bond acceptors
- 9
- Rotatable bonds
- 6
- Heavy atoms
- 16
- Formal charge
- 0
- Complexity
- 232
Physicochemical properties
- Melting point
- 49.5 · 49.5-50.5 °C
- Boiling point
- 382.83 °C · 382.83°C (rough estimate)
- Density
- 1.8742 · 1.8742 (rough estimate)
- refractive index
- 1.85 · 1.8500 (estimate)
- pka
- -10.4 · -10.40±0.70(Predicted)
Safety & regulation
Safety information is for reference only and does not replace the supplier’s Safety Data Sheet (SDS), applicable regulations, or professional assessment.
GHS classification
GHS ClassificationNot Classified
Hazard information
Hazard Classes and CategoriesNot Classified
Chemistry & industry
Suppliers1 total
SelectLab Chemicals GmbH+49-(0)2383-919350 · [email protected]
Related reactions
0 records
No reaction records under the current filter.
Compound notes
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