Hydrobentizide
[CAS# 13957-38-5]

Identification

• Name: Hydrobentizide
• Synonyms: 6-Chloro-1,1-Dioxo-3-[(Phenylmethylthio)Methyl]-3,4-Dihydro-2H-Benzo[E][1,2,4]Thiadiazine-7-Sulfonamide; 3-[(Benzylthio)Methyl]-6-Chloro-1,1-Diketo-3,4-Dihydro-2H-Benzo[E][1,2,4]Thiadiazine-7-Sulfonamide; 3-((Benzylthio)Methyl)-6-Chloro-3,4-Dihydro-2H-1,2,4-Benzothiadiazine-7-Sulfonamide 1,1-Dioxide
• Molecular Formula: C₁₅H₁₆ClN₃O₄S₃
• Molecular Weight: 433.94
• CAS Registry Number: 13957-38-5
• EINECS: 237-737-4
• SMILES: C1=C(Cl)C(=CC3=C1NC(CSCC2=CC=CC=C2)N[S]3(=O)=O)[S](N)(=O)=O
• InChI: 1S/C15H16ClN3O4S3/c16-11-6-12-14(7-13(11)25(17,20)21)26(22,23)19-15(18-12)9-24-8-10-4-2-1-3-5-10/h1-7,15,18-19H,8-9H2,(H2,17,20,21)
• InChIKey: ZUNJWRJEKCRIMZ-UHFFFAOYSA-N

Properties

• Density: 1.507g/cm³ (Cal.)
• Boiling point: 674.918°C at 760 mmHg (Cal.)
• Flash point: 361.978°C (Cal.)