HuagongsheHuagongshe Chemie-Druckbericht · Nur für Forschungszwecke
HCID 730892Erstellt: 4. November 2026
3-amino-6-fluoro-2-methylquinazolin-4(3H)-one
ZINC00143986 · Oprea1_375182 · 3-amino-6-fluoro-2-methyl-4-quinazolinone · 3-amino-6-fluoro-2-methylquinazolin-4-one · 3-amino-6-fluoro-2-methyl-quinazolin-4-one · 3-Amino-6-fluoro-2-methyl-3H-quinazolin-4-one · 3-amino-6-fluoro-2-methylquinazolin-4(3H)-one · 3-AMINO-6-FLUORO-2-METHYL-4(3H)-QUINAZOLINONE
https://huagongshe.com/de/chemical/730892
Identifikatoren & physikalische Daten
| CAS No. | 459414-73-4 |
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| Summenformel | C9H8FN3O |
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| Durchschnittliche Molmasse | 193,18 g/mol |
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| Monoisotopische Masse | 193,06514005 g/mol |
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| SMILES | Cc1nc2ccc(F)cc2c(=O)n1N |
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| InChIKey | VDDWAGDCXKFEOR-UHFFFAOYSA-N |
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| PubChem CID | 730892 |
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| EC No. | 120-949-5 |
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Chemische & physikalische Eigenschaften
| XLogP | 0,2 |
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| Polarare Oberfläche (TPSA) | 58,7 |
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| H-Brücken-Donoren | 1 |
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| H-Brücken-Akzeptoren | 4 |
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| Frei drehbare Bindungen | 0 |
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| Schwere Atome | 14 |
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| Formalladung | 0 |
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| Komplexität | 292 |
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| Siedepunkt | 361.3±44.0 °C(Predicted) |
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| Dichte | 1.46±0.1 g/cm3(Predicted) |
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| pKa (Säurekonstante) | -0+-.0.70(Predicted) |
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Sicherheit & Vorschriften
| GHS-Einstufung | WarningH302 (100%): Harmful if swallowed [Warning Acute toxicity, oral]P261, P264, P264+P265, P270, P271, P280, P301+P317, P302+P352, P304+P340, P305+P351+P338, P319, P321, P330, P332+P317, P337+P317, P362+P364, P403+P233, P405, and P501 (click each P-code to see the statement)The GHS information provided by 1 company from 1 notification to the ECHA C&L Inventory. |
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| Hazard Classes and Categories | Acute Tox. 4 (100%) |
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