Histidine hydantoin
(5S)-5-(1H-imidazol-5-ylmethyl)imidazolidine-2,4-dione
Also Known As: Histidine hydantoin|KST-1A5511|(5s)-5-(1h-imidazol-5-ylmethyl)imidazolidine-2,4-dione|2,4-Imidazolidinedione, 5-(1H-imidazol-4-ylmethyl)-, (S)-|(5S)-5-[(1H-Imidazol-5-yl)methyl]imidazolidine-2,4-dione|1,4-diamino-9,10-dioxo-9,10-dihydro-anthracene-2-carboxylic acid
CAS: 53535-33-4
| Molecular Formula | C7H8N4O2 |
|---|---|
| Molecular Weight | 180.06473 g/mol |
| LogP | -0.9 |
| Topological Polar Surface Area | 86.9 Ų |
| Hydrogen Bond Donors | 3 |
| Hydrogen Bond Acceptors | 3 |
| Rotatable Bonds | 2 |
| Exact Mass | 180.06473 |
| Monoisotopic Mass | 180.06473 |
| Heavy Atoms | 13 |
| Complexity | 243.0 |
Chemical Identifiers
| CAS Number | 53535-33-4 |
|---|---|
| SMILES | C1=C(NC=N1)C[C@H]2C(=O)NC(=O)N2 |
| InChIKey | BLKGOXMBLUVZLQ-YFKPBYRVSA-N |
Product Overview
Histidine hydantoin (CAS 53535-33-4), with molecular formula C7H8N4O2 and molecular weight 180.06473 g/mol. IUPAC: (5S)-5-(1H-imidazol-5-ylmethyl)imidazolidine-2,4-dione.
Safety Data Sheet (MSDS / SDS)
View the Laboratory Chemical Safety Summary (LCSS) on PubChem — includes GHS classifications, hazard statements, first aid measures, and handling precautions.
View MSDS →
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