Tioctilate
[CAS# 10489-23-3]

Identification

• Name: Tioctilate
• Synonyms: Benzenecarbothioic Acid S-Octyl Ester; Thiobenzoic Acid S-Octyl Ester
• Molecular Formula: C₁₅H₂₂OS
• Molecular Weight: 250.40
• CAS Registry Number: 10489-23-3
• EINECS: 234-012-4
• SMILES: C1=CC=CC=C1C(SCCCCCCCC)=O
• InChI: 1S/C15H22OS/c1-2-3-4-5-6-10-13-17-15(16)14-11-8-7-9-12-14/h7-9,11-12H,2-6,10,13H2,1H3
• InChIKey: RBWOKKSOBWYZQH-UHFFFAOYSA-N

Properties

• Density: 1g/cm³ (Cal.)
• Boiling point: 338.349°C at 760 mmHg (Cal.)
• Flash point: 136.841°C (Cal.)