Molecular properties
- Formula
- C3H5N3O9
- Molar mass
- 227.08 g·mol−1
- Exact mass
- 227.0026 Da
- 3
- PubChem CID
- 4510
Molecule record
1,3-dinitrooxypropan-2-yl nitrate
C3H5N3O9
227.08 g/mol
Loading structure
Functional groups
Alkane / alkyl carbon
Nitro compound
Physical properties
No source-backed physical properties are curated for this molecule yet.
Common names and synonyms
- 55-63-0
- Glycerol trinitrate
- Glyceryl trinitrate
- Lenitral
- Minitran
- Natispray
- Niong
- Nitora
Show all 24 synonyms
- Nitro-Bid
- Nitro-dur
- Nitrocine
- Nitroglycerine
- Nitroglycerol
- Nitroglyn
- Nitrolingual
- Nitronet
- Nitrong
- Nitrostat
- Transderm-nitro
- Tridil
- Trinitrin
- Trinitroglycerin
- Trinitroglycerol
- nitroglycerin
Structure identifiers
- Canonical SMILES
- O=[N+]([O-])OCC(CO[N+](=O)[O-])O[N+](=O)[O-]
- Isomeric SMILES
- C(C(CO[N+](=O)[O-])O[N+](=O)[O-])O[N+](=O)[O-]
- InChI
- InChI=1S/C3H5N3O9/c7-4(8)13-1-3(15-6(11)12)2-14-5(9)10/h3H,1-2H2
- InChIKey
- SNIOPGDIGTZGOP-UHFFFAOYSA-N
- PubChem CID
- 4510
Spectroscopy
Tabs appear only for spectra stored with clear provenance.
No redistributable or simulated spectroscopy record is attached yet.
Simulated NMR
On-demand educational prediction for 1,3-dinitrooxypropan-2-yl nitrate; not experimental data.
Simulated EI mass spectrum
On-demand educational fragmentation for 1,3-dinitrooxypropan-2-yl nitrate; not experimental data.
Sources
Molecule identity
Retrieved 8/20/2026. Reuse status is summarized by the badge; open the source for full details.