Basic information
- CAS
77382-82-2- Standard SMILES
CC(C)(C)N(CC(O)CC(=O)O)N=O- InChIKey
LBMDCXFARKEMBX-UHFFFAOYSA-N- Molecular formula
- C8H16N2O4
- Average molar mass
- 204.22 g/mol
- Monoisotopic mass
- 204.111007
Names & identifiers
- Preferred name
- 4-[Tert-butyl(nitroso)amino]-3-hydroxybutanoic acid
- IUPAC
- 4-[tert-butyl(nitroso)amino]-3-hydroxybutanoic acid
Names & synonyms
77382-82-24-[tert-butyl(nitroso)amino]-3-hydroxybutanoic acidDTXSID80998597Butanoic acid, 4-((1,1-dimethylethyl)nitrosoamino)-3-hydroxy-
Database identifiers
- CAS
77382-82-2- PubChem CID
- 190035
- DTXSID
DTXSID80998597
Properties
Computed structural properties
- XLogP
- 0.1
- Topological polar surface area
- 90.2 Ų
- Hydrogen bond donors
- 2
- Hydrogen bond acceptors
- 6
- Rotatable bonds
- 5
- Heavy atoms
- 14
- Formal charge
- 0
- Complexity
- 212
Related reactions
0 records
No reaction records under the current filter.
Compound notes
Loading…