2H-1,3-Oxazine-5-methanol, 3-ethyltetrahydro-5-nitro-
Basic information
- CAS
96286-41-8- Standard SMILES
CCN1COCC(CO)([N+](=O)[O-])C1- InChIKey
ZZSOLQXHSQAFET-UHFFFAOYSA-N- Molecular formula
- C7H14N2O4
- Average molar mass
- 190.2 g/mol
- Monoisotopic mass
- 190.09535693
Names & identifiers
- Preferred name
- 2H-1,3-Oxazine-5-methanol, 3-ethyltetrahydro-5-nitro-
- IUPAC
- (3-ethyl-5-nitro-1,3-oxazinan-5-yl)methanol
Names & synonyms
96286-41-82H-1,3-Oxazine-5-methanol, 3-ethyltetrahydro-5-nitro-(3-ethyl-5-nitro-1,3-oxazinan-5-yl)methanolDTXSID70328829
Database identifiers
- CAS
96286-41-8- PubChem CID
- 414265
- DTXSID
DTXSID70328829
Properties
Computed structural properties
- XLogP
- -0.7
- Topological polar surface area
- 78.5 Ų
- Hydrogen bond donors
- 1
- Hydrogen bond acceptors
- 5
- Rotatable bonds
- 2
- Heavy atoms
- 13
- Formal charge
- 0
- Complexity
- 193
Related reactions
0 records
No reaction records under the current filter.
Compound notes
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