1-(2-Chloroethyl)-3-(3,4-Dihydro-2H-1-Benzothiopyran-4-Yl)Urea
[CAS# 27047-62-7]

Identification

• Name: 1-(2-Chloroethyl)-3-(3,4-Dihydro-2H-1-Benzothiopyran-4-Yl)Urea
• Synonyms: 3-(2-Chloroethyl)-1-Thiochroman-4-Yl-Urea; 3-(2-Chloroethyl)-1-(4-Thiochromanyl)Urea; 1-(2-Chloroethyl)-3-(4-Thiochromanyl)Urea
• Molecular Formula: C₁₂H₁₅ClN₂OS
• Molecular Weight: 270.78
• CAS Registry Number: 27047-62-7
• SMILES: C1=CC=CC2=C1C(NC(=O)NCCCl)CCS2
• InChI: 1S/C12H15ClN2OS/c13-6-7-14-12(16)15-10-5-8-17-11-4-2-1-3-9(10)11/h1-4,10H,5-8H2,(H2,14,15,16)
• InChIKey: FPMGZVWNTSTEOW-UHFFFAOYSA-N

Properties

• Density: 1.301g/cm³ (Cal.)
• Boiling point: 477.674°C at 760 mmHg (Cal.)
• Flash point: 242.689°C (Cal.)