3-(2,5-Dimethoxyphenyl)Propyl 4-Methylbenzenesulfonate
[CAS# 72018-07-6]

Identification

• Name: 3-(2,5-Dimethoxyphenyl)Propyl 4-Methylbenzenesulfonate
• Synonyms: 4-Methylbenzenesulfonic Acid 3-(2,5-Dimethoxyphenyl)Propyl Ester; Benzenepropanol, 2,5-Dimethoxy-, 4-Methylbenzenesulfonate; 3-(2,5-Dimethoxyphenyl)Propyl P-Toluenesulfonate
• Molecular Formula: C₁₈H₂₂O₅S
• Molecular Weight: 350.43
• CAS Registry Number: 72018-07-6
• SMILES: C1=C(C=CC(=C1)C)[S](=O)(=O)OCCCC2=C(C=CC(=C2)OC)OC
• InChI: 1S/C18H22O5S/c1-14-6-9-17(10-7-14)24(19,20)23-12-4-5-15-13-16(21-2)8-11-18(15)22-3/h6-11,13H,4-5,12H2,1-3H3
• InChIKey: RFCULXOOMIOJCF-UHFFFAOYSA-N

Properties

• Density: 1.186g/cm³ (Cal.)
• Boiling point: 504.27°C at 760 mmHg (Cal.)
• Flash point: 258.774°C (Cal.)