1-[(3-Bromo-4-Ethoxyphenyl)Methyl]-3-[[(E)-(6-Oxo-1-Cyclohexa-2,4-Dienylidene)Methyl]Amino]Thiourea
[CAS# 186453-56-5]

Identification

• Name: 1-[(3-Bromo-4-Ethoxyphenyl)Methyl]-3-[[(E)-(6-Oxo-1-Cyclohexa-2,4-Dienylidene)Methyl]Amino]Thiourea
• Synonyms: 1-[(3-Bromo-4-Ethoxy-Phenyl)Methyl]-3-[[(E)-(6-Oxo-1-Cyclohexa-2,4-Dienylidene)Methyl]Amino]Thiourea; 1-(3-Bromo-4-Ethoxy-Benzyl)-3-[[(E)-(6-Keto-1-Cyclohexa-2,4-Dienylidene)Methyl]Amino]Thiourea; Hydrazinecarbothioamide, N-((3-Bromo-4-Ethoxyphenyl)Methyl)-2-((2-Hydroxyphenyl)Methylene)-
• Molecular Formula: C₁₇H₁₈BrN₃O₂S
• Molecular Weight: 408.31
• CAS Registry Number: 186453-56-5
• SMILES: C2=C(CNC(=S)NN/C=C1/C(=O)C=CC=C1)C=CC(=C2Br)OCC
• InChI: 1S/C17H18BrN3O2S/c1-2-23-16-8-7-12(9-14(16)18)10-19-17(24)21-20-11-13-5-3-4-6-15(13)22/h3-9,11,20H,2,10H2,1H3,(H2,19,21,24)/b13-11+
• InChIKey: VVUDLAWKZUCMGM-ACCUITESSA-N

Properties

• Density: 1.501g/cm³ (Cal.)
• Boiling point: 531.148°C at 760 mmHg (Cal.)
• Flash point: 275.029°C (Cal.)