2-Amino-3-azido-2-methylpropanoic acid
Basic information
- CAS
120042-13-9- Standard SMILES
CC(N)(CN=[N+]=[N-])C(=O)O- InChIKey
WDJUCIRNDRCXTL-UHFFFAOYSA-N- Molecular formula
- C4H8N4O2
- Average molar mass
- 144.13 g/mol
- Monoisotopic mass
- 144.06472551
Names & identifiers
- Preferred name
- 2-Amino-3-azido-2-methylpropanoic acid
- IUPAC
- 2-amino-3-azido-2-methylpropanoic acid
- English name
- 2-amino-3-azido-2-methyl-propanoic acid
- Molecular formula
- C4H8N4O2
- Molecular weight
- 144.13
Names & synonyms
2-amino-3-azido-2-methylpropanoic acid120042-13-93-Azido-2-methyl-DL-alanineCCRIS 3364Racemic alpha-methylazidoalanineDL-Alanine, 3-azido-2-methyl-2-AMINO-3-AZIDO-2-METHYL-PROPANOIC ACIDSCHEMBL18472525DTXSID00923200
Database identifiers
- CAS
120042-13-9- PubChem CID
- 147479
- DTXSID
DTXSID00923200
Properties
Computed structural properties
- XLogP
- -2.3
- Topological polar surface area
- 77.7 Ų
- Hydrogen bond donors
- 2
- Hydrogen bond acceptors
- 5
- Rotatable bonds
- 3
- Heavy atoms
- 10
- Formal charge
- 0
- Complexity
- 186
Physicochemical properties
- Boiling point
- 262.72 °C · 262.72°C (rough estimate)
- Density
- 1.4165 · 1.4165 (rough estimate)
- refractive index
- 1.85 · 1.8500 (estimate)
- Toxicity
- 25 mmol/plate · mic-sat 25 mmol/plate MUREAV 216,27,1989
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
- Toxicity
- mic-sat 25 mmol/plate MUREAV 216,27,1989
Related reactions
0 records
No reaction records under the current filter.
Compound notes
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