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医药中间体及原料药
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Creatinine · CAS 60-27-5 · C4H7N3O. UNII AYI8EX34EU. Melting Point: 303 °C (decomposes); Solubility: 80.1 mg/mL at 16 °C; Vapor Pressure: 0.000217 [mmHg].
| CAS Registry Number | 60-27-5 |
|---|---|
| PubChem CID | 588 |
| Molecular formula | C4H7N3O |
| IUPAC name | 2-amino-3-methyl-4H-imidazol-5-one |
| UNII (FDA) | AYI8EX34EU |
| Molecular Weight | 113.12 |
|---|---|
| XLogP3 | -1.8 |
| Hydrogen Bond Donor Count | 1 |
| Hydrogen Bond Acceptor Count | 1 |
| Rotatable Bond Count | 0 |
| Exact Mass | 113.058911855 |
| Monoisotopic Mass | 113.058911855 |
| Topological Polar Surface Area | 58.7 |
| Heavy Atom Count | 8 |
| Formal Charge | 0 |
| Melting Point | 303 °C (decomposes) |
|---|---|
| Solubility | 80.1 mg/mL at 16 °C |
| Vapor Pressure | 0.000217 [mmHg] |
| LogP | -1.76 |
| Collision Cross Section | 123.4 Ų [M+H]+ |
| Collision Cross Section | 123.3 Ų [M+H]+ |
| Collision Cross Section | 132.8 Ų [M+Na]+ |
| Collision Cross Section | 132.9 Ų [M+Na]+ |
| Collision Cross Section | 119.8 Ų [M-H]- |
| Collision Cross Section | 119.1 Ų [M-H]- |
| Regulatory & Food Contact | CIR / INCI: Skin conditioning |
|---|---|
| GHS notification summary | 60% (6 / 10) |
| GHS notification summary | 60% (6 / 10) |
|---|---|
| Reported hazard statements | H315 (40%), H319 (40%), H335 (40%), H336 (10%) |
This chemical does not meet GHS hazard criteria for 60% (6 of 10) of all reports.
H315 (40%): Causes skin irritation [Warning Skin corrosion/irritation]
2-Imino-1-methylimidazolidin-4-one; 1-Methylglycocyamidine; 1-Methylhydantoin-2-imide; Kreatinin; Creatinine,heated; Kreatininum; 2-amino-1-methylimidazolin-4-one; 2-amino-3-methyl-4H-imidazol-5-one; 2-amino-1-methyl-1,5-dihydro-4H-imidazol-4-one; 4H-Imidazol-4-one, 2-amino-1,5-dihydro-1-methyl-; creatinina; NSC-13123; AYI8EX34EU; 2-Amino-1,5-dihydro-1-methyl-4H-imidazol-4-one; CHEMBL65567; CHEBI:16737
CAS 60-27-5; molecular formula C4H7N3O; molecular weight — g/mol.
2-Imino-1-methylimidazolidin-4-one, 1-Methylglycocyamidine, 1-Methylhydantoin-2-imide, Kreatinin, Creatinine,heated, Kreatininum.
Documented regulatory listings: CIR / INCI: Skin conditioning.
60% of GHS notifications report no hazard classification (6 of 10).
Melting Point: 303 °C (decomposes); Solubility: 80.1 mg/mL at 16 °C; Vapor Pressure: 0.000217 [mmHg]; LogP: -1.76.
Facts on this page are taken from PubChem (US National Library of Medicine) and Wikidata. Grade-specific data — assay, moisture, particle size, packaging, shelf life — is issued per batch on the COA and is not published here.