Grundinformationen
- CAS
6843-49-8- Standard-SMILES
CC1(c2ccccc2)NC(=O)NC1=O- InChIKey
JNGWGQUYLVSFND-UHFFFAOYSA-N- Summenformel
- C10H10N2O2
- Durchschnittliche Molmasse
- 190,2 g/mol
- Monoisotopische Masse
- 190,07422757
Namen und Bezeichner
- Bevorzugter Name
- 5-Methyl-5-phenylhydantoin
- IUPAC
- 5-methyl-5-phenylimidazolidine-2,4-dione
- Lokaler Name
- 5-Methyl-5-phenylimidazolidin-2,4-dion
- Englischer Name
- 5-METHYL-5-PHENYLHYDANTOIN
- Summenformel
- C10H10N2O2
- Molmasse
- 190.2
Namen und Synonyme
5-Methyl-5-phenylhydantoin6843-49-85-Methyl-5-phenylimidazolidine-2,4-dioneHydantoin, 5-methyl-5-phenyl-2,4-Imidazolidinedione, 5-methyl-5-phenyl-AI3-03732NSC-14839R5C75HK8E7DTXSID201311373RefChem:103161DTXCID701012198229-928-6
Weitere Namen anzeigen
cb1664NSC 14839MPID Standard5-methyl-5-benzeneHydantoin Impurity 19Chiral Test Mix for Astec5-methyl-5-phenyl-hydantoiHydantoin, 5-methyl-5-phenyl.5-Methyl-5-phenylhydantoin,99%
MFCD000052655-Methyl-5-phenyl-2,4-imidazolidinedioneEINECS 229-928-6Hydantoin, 5-methyl-5-phenyl- (6CI,7CI,8CI); 5-Methyl-5-phenyl-2,4-imidazolidinedione; (+/-)-5-Methyl-5-phenylhydantoin; 5-Methyl-5-phenylhydantoin; 5-Methyl-5-phenylimidazolidine-2,4-dione; NSC 148392, 5-methyl-5-phenyl-Oprea1_423715SCHEMBL542865orb3029311
Datenbank-Bezeichner
- CAS
Eigenschaften
Berechnete Struktureigenschaften
- XLogP
- 1
- Polarare Oberfläche (TPSA)
- 58,2 Ų
- H-Brücken-Donoren
- 2
- H-Brücken-Akzeptoren
- 2
- Frei drehbare Bindungen
- 1
- Schwere Atome
- 14
- Formalladung
- 0
- Komplexität
- 271
Experimentelle und physikochemische Eigenschaften
Kovats Retention Index1866；1866
Physikochemische Eigenschaften
- Schmelzpunkt
- 199 · 199-201 °C (lit.)
- Siedepunkt
- 325.7 °C · 325.7°C (rough estimate)
- Dichte
- 1.2167 · 1.2167 (rough estimate)
- Brechungsindex
- 1.63 · 1.6300 (estimate)
- Flammpunkt
- 9 ℃ · 9℃
- storage temp.
- 2 · Inert atmosphere,2-8°C
- Löslichkeit
- DMSO (Slightly), Ethanol (Slightly), Methanol (Slightly)
- Aggregatzustand
- Crystalline Powder
- pka
- 8.6 · 8.60±0.10(Predicted)
- Farbe
- White
- InChI
- InChI=1S/C10H10N2O2/c1-10(7-5-3-2-4-6-7)8(13)11-9(14)12-10/h2-6H,1H3,(H2,11,12,13,14)
- InChIKey
- JNGWGQUYLVSFND-UHFFFAOYSA-N
Sicherheit und Regulatorisches
GHS-Klassifizierung
GHS Classification
Warning
H302 (100%): Harmful if swallowed [Warning Acute toxicity, oral]；H319 (100%): Causes serious eye irritation [Warning Serious eye damage/eye irritation]
P264, P264+P265, P270, P280, P301+P317, P305+P351+P338, P330, P337+P317, and P501 (click each P-code to see the statement)
Aggregated GHS information provided per 41 reports by companies from 2 notifications to the ECHA C&L Inventory. Each notification may be associated with multiple companies.；Information may vary between notifications depending on impurities, additives, and other factors. The percentage value in parenthesis indicates the notified classification ratio from companies that provide hazard codes. Only hazard codes with percentage values above 10% are shown. For more detailed information, please visit ECHA C&L website.
Gefahrenhinweise
Regulatory InformationCommission Regulation No 844/2012
Hazard Classes and CategoriesAcute Tox. 4 (100%)；Eye Irrit. 2A (100%)
Regulatorische Informationen
Regulatory InformationCommission Regulation No 844/2012
Sicherheitsdaten
- wgk
- 3
- ridadr
- UN1230 - class 3 - PG 2 - Methanol, solution
- hs_code
- 29332100
- RTECS-Nr.
- MU2625500
- risk_code
- 22-36
- Toxizität
- LD50 subcutaneous in mouse: 560mg/kg
- hazard_code
- Xn
Chemie und Industrie
Anwendungen
Verwenden5-Methyl-5-phenylhydantoin is a reactant for synthesis of beta-amino alcohols as inhibitors of anti-tubercular target N-acetyltransferase, chlorohydantoins and specific MMP inhibitors.
Anbieter50 Anbieter
阿诺西（上海）生物技术有限公司400-1107768 15058188853 · [email protected]
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