2,2-Dinitropropyl ethylsulfanylformate
Basic information
- CAS
71674-17-4- Standard SMILES
CCSC(=O)OCC(C)([N+](=O)[O-])[N+](=O)[O-]- InChIKey
MBPNSTDECIESKY-UHFFFAOYSA-N- Molecular formula
- C6H10N2O6S
- Average molar mass
- 238.22 g/mol
- Monoisotopic mass
- 238.02595722
Names & identifiers
- Preferred name
- 2,2-Dinitropropyl ethylsulfanylformate
- IUPAC
- 2,2-dinitropropyl ethylsulfanylformate
Names & synonyms
71674-17-42,2-dinitropropyl ethylsulfanylformateNSC312440DTXSID20317187NSC-312440O-(2,2-Dinitropropyl) S-ethyl carbonothioate
Database identifiers
- CAS
71674-17-4- PubChem CID
- 329460
- DTXSID
DTXSID20317187
Properties
Computed structural properties
- XLogP
- 1.5
- Topological polar surface area
- 143 Ų
- Hydrogen bond donors
- 0
- Hydrogen bond acceptors
- 7
- Rotatable bonds
- 5
- Heavy atoms
- 15
- Formal charge
- 0
- Complexity
- 256
Related reactions
0 records
No reaction records under the current filter.
Compound notes
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