4-Amino-3,5-diiodophenylalanine
Basic information
- CAS
59515-83-2- Standard SMILES
Nc1c(I)cc(CC(N)C(=O)O)cc1I- InChIKey
XVRWUAYKWQYHII-UHFFFAOYSA-N- Molecular formula
- C9H10I2N2O2
- Average molar mass
- 432 g/mol
- Monoisotopic mass
- 431.88317356
Names & identifiers
- Preferred name
- 4-Amino-3,5-diiodophenylalanine
- IUPAC
- 2-amino-3-(4-amino-3,5-diiodophenyl)propanoic acid
- English name
- 4-Amino-3 5-diiodo-L-phenylalanine
- Molecular formula
- C9H10I2N2O2
- Molecular weight
- 432
Names & synonyms
4-Amino-3,5-diiodophenylalanine59515-83-2DTXSID30314445RefChem:289880DTXCID302655692-amino-3-(4-amino-3,5-diiodophenyl)propanoic acidNSC283482SCHEMBL7318580NSC-283482H-4-Amino-3,5-diiodo-Phe-OHL-Phenylalanine, 4-amino-3,5-diiodo-
Database identifiers
- CAS
59515-83-2- PubChem CID
- 323429
- DTXSID
DTXSID30314445
Properties
Computed structural properties
- XLogP
- -0.8
- Topological polar surface area
- 89.3 Ų
- Hydrogen bond donors
- 3
- Hydrogen bond acceptors
- 4
- Rotatable bonds
- 3
- Heavy atoms
- 15
- Formal charge
- 0
- Complexity
- 228
Physicochemical properties
- storage temp.
- 20 °C · −20°C
- Comptox DTXSID
- 30314445 · DTXSID30314445
- WGK Germany
- 3 · 3
- 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
- wgk
- 3
- hs_code
- 2922499990
Related reactions
0 records
No reaction records under the current filter.
Compound notes
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