Basic information
- CAS
32051-21-1- Standard SMILES
CC(C)(C)N1COCC(CO)([N+](=O)[O-])C1- InChIKey
XVHGCUHMCSFWJS-UHFFFAOYSA-N- Molecular formula
- C9H18N2O4
- Average molar mass
- 218.25 g/mol
- Monoisotopic mass
- 218.12665706
Names & identifiers
- Preferred name
- (3-tert-Butyl-5-nitro-1,3-oxazinan-5-yl)methanol
- IUPAC
- (3-tert-butyl-5-nitro-1,3-oxazinan-5-yl)methanol
Names & synonyms
(3-tert-Butyl-5-nitro-1,3-oxazinan-5-yl)methanol32051-21-1DTXSID10346027RefChem:207812DTXCID50297100MFCD02648402[3-(tert-butyl)-5-nitro-1,3-oxazinan-5-yl]methanolOprea1_416140SCHEMBL13043324XVHGCUHMCSFWJS-UHFFFAOYSA-NSBB002456STK764071
Show more names
AKOS001740029AKOS016347425SY310167EU-0052706ST45381863SR-01000531800SR-01000531800-1(3-{tert}-butyl-5-nitro-1,3-oxazinan-5-yl)methanol
Database identifiers
- CAS
32051-21-1- PubChem CID
- 608909
- DTXSID
DTXSID10346027
Properties
Computed structural properties
- XLogP
- -0.1
- Topological polar surface area
- 78.5 Ų
- Hydrogen bond donors
- 1
- Hydrogen bond acceptors
- 5
- Rotatable bonds
- 2
- Heavy atoms
- 15
- Formal charge
- 0
- Complexity
- 245
Related reactions
0 records
No reaction records under the current filter.
Compound notes
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