Basic information
- CAS
643-97-0- Standard SMILES
O=[N+]([O-])OCC(O[N+](=O)[O-])C(CO[N+](=O)[O-])O[N+](=O)[O-]- InChIKey
SNFOERUNNSHUGP-UHFFFAOYSA-N- Molecular formula
- C4H6N4O12
- Average molar mass
- 302.11 g/mol
- Monoisotopic mass
- 301.99822164
Names & identifiers
- Preferred name
- Tetranitrin
- IUPAC
- 1,3,4-trinitrooxybutan-2-yl nitrate
Names & synonyms
TetranitrinCardiloidCardivellCardiwellErythritetranitratErythritol, tetranitratebutane-1,2,3,4-tetrayl tetranitrate1,3,4-trinitrooxybutan-2-yl nitrateSCHEMBL613474Erythritol tetranitrate (ETN)CHEMBL4536361,2,3,4-Butanetetrayl nitrate
Show more names
DTXSID208600071,3,4-Butanetetralyl tetranitrate643-97-0NS000100611,3,4-Butanetetrol, tetranitrate, (R*,S*)-
Database identifiers
- CAS
643-97-0、7297-25-8- PubChem CID
- 23723
- DTXSID
DTXSID20860007- ChEMBL
CHEMBL453636- Nikkaji
- J8.922B
Properties
Computed structural properties
- XLogP
- 1.4
- Topological polar surface area
- 220 Ų
- Hydrogen bond donors
- 0
- Hydrogen bond acceptors
- 12
- Rotatable bonds
- 7
- Heavy atoms
- 20
- Formal charge
- 0
- Complexity
- 326
Related reactions
0 records
No reaction records under the current filter.
Compound notes
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