4-Amino-4-phosphonobutyric acid
Basic information
- CAS
18865-31-1- Standard SMILES
NC(CCC(=O)O)P(=O)(O)O- InChIKey
SODXFOVXZATGPJ-UHFFFAOYSA-N- Molecular formula
- C4H10NO5P
- Average molar mass
- 183.1 g/mol
- Monoisotopic mass
- 183.02965942
Overview
used in making phosphono peptides with antibacterial activity
Names & identifiers
- Preferred name
- 4-Amino-4-phosphonobutyric acid
- IUPAC
- 4-amino-4-phosphonobutanoic acid
- English name
- 4-amino-4-phosphonobutyric acid
- Molecular formula
- C4H10NO5P
- Molecular weight
- 0
Names & synonyms
4-Amino-4-phosphonobutyric acid18865-31-1RefChem:977764-amino-4-phosphonobutanoic acidNSC133883NSC-133883SCHEMBL11914574-amino-4-phosphono butyric acidPDSP1_001330PDSP2_001314Butanoic acid, 4-amino-4-phosphono-NSC 133883
Database identifiers
- CAS
18865-31-1- PubChem CID
- 98450
- Nikkaji
- J478.114G
Properties
Computed structural properties
- XLogP
- -4.8
- Topological polar surface area
- 121 Ų
- Hydrogen bond donors
- 4
- Hydrogen bond acceptors
- 6
- Rotatable bonds
- 4
- Heavy atoms
- 11
- Formal charge
- 0
- Complexity
- 187
Physicochemical properties
- HS Code
- 2931900090 · 2931900090
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
- 2931900090
Related reactions
0 records
No reaction records under the current filter.
Compound notes
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