2-[2-(1-Carboxyethylamino)ethylamino]propanoic acid;hydrobromide
Basic information
- CAS
6951-95-7- Standard SMILES
Br.CC(NCCNC(C)C(=O)O)C(=O)O- InChIKey
YLRHJRNQIXPLCV-UHFFFAOYSA-N- Molecular formula
- C8H17BrN2O4
- Average molar mass
- 285.14 g/mol
- Monoisotopic mass
- 284.03717
Names & identifiers
- Preferred name
- 2-[2-(1-Carboxyethylamino)ethylamino]propanoic acid;hydrobromide
- IUPAC
- 2-[2-(1-carboxyethylamino)ethylamino]propanoic acid;hydrobromide
Names & synonyms
NSC58881NSC-58881
Database identifiers
- CAS
6951-95-7- PubChem CID
- 54601331
Properties
Computed structural properties
- Topological polar surface area
- 98.7 Ų
- Hydrogen bond donors
- 5
- Hydrogen bond acceptors
- 6
- Rotatable bonds
- 7
- Heavy atoms
- 15
- Formal charge
- 0
- Complexity
- 186
Related reactions
0 records
No reaction records under the current filter.
Compound notes
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