Ethyl N-[(3,4-Dimethoxyphenyl)Sulfonyl]-N-(2-Furylmethyl)-beta-Alaninate
[CAS# 185300-64-5]

Identification

• Name: Ethyl N-[(3,4-Dimethoxyphenyl)Sulfonyl]-N-(2-Furylmethyl)-beta-Alaninate
• Synonyms: B-ALANINE,N-[(3,4-DIMETHOXYPHENYL)SULFONYL]-N-(2-FURANYLMETHYL)-, ETHYL ESTER; ethyl 3-[[(3,4-dimethoxyphenyl)sulphonyl](2-furylmethyl)amino]propanoate; ZINC02381182
• Molecular Formula: C₁₈H₂₃NO₇S
• Molecular Weight: 397.44
• CAS Registry Number: 185300-64-5
• SMILES: O=S(=O)(N(Cc1occc1)CCC(=O)OCC)c2ccc(OC)c(OC)c2
• InChI: 1S/C18H23NO7S/c1-4-25-18(20)9-10-19(13-14-6-5-11-26-14)27(21,22)15-7-8-16(23-2)17(12-15)24-3/h5-8,11-12H,4,9-10,13H2,1-3H3
• InChIKey: UGQKTNWJBOAJBJ-UHFFFAOYSA-N

Properties

• Density: 1.258g/cm³ (Cal.)
• Boiling point: 534.363°C at 760 mmHg (Cal.)
• Flash point: 276.973°C (Cal.)
• Refractive index: 1.539 (Cal.)