Cetaben
[CAS# 55986-43-1]

Identification

• Name: Cetaben
• Synonyms: Sodium 4-(Cetylamino)Benzoate; Cetaben Sodium (Usan); D03447
• Molecular Formula: C₂₃H₃₈NNaO₂
• Molecular Weight: 383.55
• CAS Registry Number: 55986-43-1
• SMILES: C1=C(C=CC(=C1)NCCCCCCCCCCCCCCCC)C([O-])=O.[Na+]
• InChI: 1S/C23H39NO2.Na/c1-2-3-4-5-6-7-8-9-10-11-12-13-14-15-20-24-22-18-16-21(17-19-22)23(25)26;/h16-19,24H,2-15,20H2,1H3,(H,25,26);/q;+1/p-1
• InChIKey: RIEGDRWQKNITRV-UHFFFAOYSA-M

Properties

• Boiling point: 503.4°C at 760 mmHg (Cal.)
• Flash point: 258.3°C (Cal.)