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HCID 94411Erstellt: 27. Oktober 2026
2-Amino-N-(isopropyl)benzamid
n-isopropylanthranilamide · AKOS BBB/073 · BUTTPARK 51\02-31 · Benzyl Benzoate Impurity 11 · N-Isopropyl-2-aminobenzamide · 2-AMINO-N-ISOPROPYL BENZAMIDE · 2-amino-N-propan-2-ylbenzamide · Benzamide, o-amino-N-isopropyl-
https://huagongshe.com/de/chemical/94411
Identifikatoren & physikalische Daten
| CAS No. | 30391-89-0 |
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| Summenformel | C10H14N2O |
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| Durchschnittliche Molmasse | 178,23 g/mol |
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| Monoisotopische Masse | 178,11061307 g/mol |
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| SMILES | CC(C)NC(=O)c1ccccc1N |
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| InChIKey | FWQYJOPJMIEKHZ-UHFFFAOYSA-N |
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| PubChem CID | 94411 |
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| ChEMBL | CHEMBL3186283 |
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| EC No. | 250-175-4 |
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| DTXSID | DTXSID7041627 |
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| Lokaler Name | 2-Amino-N-(isopropyl)benzamid |
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Chemische & physikalische Eigenschaften
| XLogP | 1,4 |
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| Polarare Oberfläche (TPSA) | 55,1 |
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| H-Brücken-Donoren | 2 |
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| H-Brücken-Akzeptoren | 2 |
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| Frei drehbare Bindungen | 2 |
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| Schwere Atome | 13 |
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| Formalladung | 0 |
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| Komplexität | 180 |
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| Pestizide | Pesticide degradation product |
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| Collision Cross Section | 140.8 Ų [M-H]- [CCS Type: DTBuffer gas: N2Ionization: ESI-Dataset: TOXCASTSource Identifier: DTXSID7041627] |
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| Schmelzpunkt | 147 °C |
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| Siedepunkt | 355.7±25.0 °C(Predicted) |
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| Dichte | 1.077±0.06 g/cm3(Predicted) |
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| Lagerbedingungen | -20°C Freezer, Under inert atmosphere |
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| Löslichkeit | Chloroform (Slightly), Methanol (Slightly) |
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| pKa (Säurekonstante) | 14.43±0.46(Predicted) |
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| Farbe | Off-White to Light Brown |
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| BRN | 2804946 |
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| EPA chemische Informationen | Benzamide, 2-amino-N-(1-methylethyl)- (30391-89-0) |
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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)Aggregated GHS information provided per 44 reports by companies from 4 notifications to the ECHA C&L Inventory. Each notification may be associated with multiple companies. |
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| Hazard Classes and Categories | Acute Tox. 4 (100%) |
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| USGS Health-Based Screening Levels for Evaluating Water-Quality | 2-Amino-N-isopropylbenzamidePesticide degradation productSmith, C.D. and Nowell, L.H., 2024. Health-Based Screening Levels for evaluating water-quality data (3rd ed.). DOI:10.5066/F71C1TWP |
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| Wassergefährdungsklasse (WGK) | 3 |
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| TSCA-Inventar-Status | TSCA listed |
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| R-Sätze (R) | 22-36/37/38 |
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| Gefahrensymbole | Xi,Xn |
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| Sicherheitshinweise (S) | 26 |
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| Gefahrenklasse | IRRITANT |
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