HuagongsheHuagongshe Chemie-Druckbericht · Nur für Forschungszwecke
HCID 3549191Erstellt: 27. Oktober 2026
Propane-2-sulfonamide
2-Propanesulfonamide · Isopropylsulfonamide · Propan-2-sulfonamide · propane-2-sulfonamide · Isopropylsulphonamide 98% · 2-Propanesulfonamide (9CI, ACI) · IsopropylsulfonamidePropane-2-sulfonamide · Propane-2-sulphonamide, 2-Sulphamoylpropane
https://huagongshe.com/de/chemical/3549191
Identifikatoren & physikalische Daten
| CAS No. | 81363-76-0 |
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| Summenformel | C3H9NO2S |
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| Durchschnittliche Molmasse | 123,18 g/mol |
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| Monoisotopische Masse | 123,03539953 g/mol |
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| SMILES | CC(C)S(N)(=O)=O |
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| InChIKey | SJMCLWCCNYAWRQ-UHFFFAOYSA-N |
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| PubChem CID | 3549191 |
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| EC No. | 816-007-4 |
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| DTXSID | DTXSID80393543 |
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Chemische & physikalische Eigenschaften
| XLogP | -0,3 |
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| Polarare Oberfläche (TPSA) | 68,5 |
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| H-Brücken-Donoren | 1 |
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| H-Brücken-Akzeptoren | 3 |
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| Frei drehbare Bindungen | 1 |
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| Schwere Atome | 7 |
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| Formalladung | 0 |
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| Komplexität | 130 |
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| Schmelzpunkt | 61-65 °C(Solv: chloroform (67-66-3)carbon tetrachloride (56-23-5)) |
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| Siedepunkt | 216.5±23.0 °C(Predicted) |
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| Dichte | 1.194±0.06 g/cm3(Predicted) |
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| Lagerbedingungen | Sealed in dry,Room Temperature |
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| pKa (Säurekonstante) | 10.69±0.60(Predicted) |
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| InChI | InChI=1S/C3H9NO2S/c1-3(2)7(4,5)6/h3H,1-2H3,(H2,4,5,6) |
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| InChIKey | SJMCLWCCNYAWRQ-UHFFFAOYSA-N |
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| SMILES | CC(S(N)(=O)=O)C |
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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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| Zollcode | 2935909099 |
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