HuagongsheHuagongshe Chemie-Druckbericht · Nur für Forschungszwecke
HCID 792201Erstellt: 1. November 2026
3-Benzenesulfonamidobenzoic acid
3-(benzenesulfonamido)benzoate · 3-(Phenylsulfonamido)benzoic acid · 3-Benzenesulfonylaminobenzoic acid · 3-[(PHENYLSULFONYL)AMINO]BENZOIC ACID · Benzoic acid, 3-[(phenylsulfonyl)amino]-
https://huagongshe.com/de/chemical/792201
Identifikatoren & physikalische Daten
| CAS No. | 28547-15-1 |
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| Summenformel | C13H11NO4S |
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| Durchschnittliche Molmasse | 277,3 g/mol |
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| Monoisotopische Masse | 277,04087901 g/mol |
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| SMILES | O=C(O)c1cccc(NS(=O)(=O)c2ccccc2)c1 |
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| InChIKey | RELBUFSHELNQKC-UHFFFAOYSA-N |
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| PubChem CID | 792201 |
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| ChEMBL | CHEMBL490915 |
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| EC No. | 673-323-3 |
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Chemische & physikalische Eigenschaften
| XLogP | 2,1 |
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| Polarare Oberfläche (TPSA) | 91,9 |
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| H-Brücken-Donoren | 2 |
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| H-Brücken-Akzeptoren | 5 |
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| Frei drehbare Bindungen | 4 |
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| Schwere Atome | 19 |
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| Formalladung | 0 |
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| Komplexität | 409 |
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| Schmelzpunkt | 203-204 °C |
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| Siedepunkt | 492.3±47.0 °C(Predicted) |
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| Dichte | 1.451±0.06 g/cm3(Predicted) |
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| pKa (Säurekonstante) | 4.04±0.10(Predicted) |
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| Aggregatzustand | solid |
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| Farbe | Beige |
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Sicherheit & Vorschriften
| GHS-Einstufung | WarningH302 (50%): 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 2 reports by companies from 2 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 (50%) |
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| Zollcode | 2935909099 |
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