5-Nitronorvaline
Basic information
- CAS
21753-92-4- Standard SMILES
N[C@@H](CCC[N+](=O)[O-])C(=O)O- InChIKey
XEPMGNVHTHVQNX-BYPYZUCNSA-N- Molecular formula
- C5H10N2O4
- Average molar mass
- 162.14 g/mol
- Monoisotopic mass
- 162.0640568
Names & identifiers
- Preferred name
- 5-Nitronorvaline
- IUPAC
- (2S)-2-amino-5-nitropentanoic acid
- English name
- 5-nitronorvaline
- Molecular formula
- C5H10N2O4
- Molecular weight
- 162.14
Names & synonyms
5-Nitro-L-norvaline5-Nitronorvaline21753-92-4L-Norvaline, 5-nitro-DTXSID70944361RefChem:103272DTXCID001372707SCHEMBL10428887
Database identifiers
- CAS
21753-92-4- PubChem CID
- 193576
- DTXSID
DTXSID70944361- Nikkaji
- J83.097F
Properties
Computed structural properties
- XLogP
- -2.8
- Topological polar surface area
- 109 Ų
- Hydrogen bond donors
- 2
- Hydrogen bond acceptors
- 5
- Rotatable bonds
- 4
- Heavy atoms
- 11
- Formal charge
- 0
- Complexity
- 153
Physicochemical properties
- HS Code
- 2922499990 · 2922499990
Safety & regulation
Safety information is for reference only and does not replace the supplier’s Safety Data Sheet (SDS), applicable regulations, or professional assessment.
Safety data
- hs_code
- 2922499990
Related reactions
0 records
No reaction records under the current filter.
Compound notes
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