Disodium N-(2-Carboxyethyl)-N-(1-Oxododecyl)-beta-Alaninate
[CAS# 52900-31-9]

Identification

• Name: Disodium N-(2-Carboxyethyl)-N-(1-Oxododecyl)-beta-Alaninate
• Synonyms: Disodium 3-[Dodecanoyl-(3-Oxido-3-Oxo-Propyl)Amino]Propanoate; Disodium 3-[(3-Oxido-3-Oxopropyl)-(1-Oxododecyl)Amino]Propanoate; Disodium 3-[(3-Keto-3-Oxido-Propyl)-Lauroyl-Amino]Propionate
• Molecular Formula: C₁₈H₃₁NNa₂O₅
• Molecular Weight: 387.43
• CAS Registry Number: 52900-31-9
• EINECS: 258-248-2
• SMILES: C(N(C(=O)CCCCCCCCCCC)CCC([O-])=O)CC([O-])=O.[Na+].[Na+]
• InChI: 1S/C18H33NO5.2Na/c1-2-3-4-5-6-7-8-9-10-11-16(20)19(14-12-17(21)22)15-13-18(23)24;;/h2-15H2,1H3,(H,21,22)(H,23,24);;/q;2*+1/p-2
• InChIKey: SQCPKEDRDDRNHU-UHFFFAOYSA-L

Properties

• Boiling point: 536.6°C at 760 mmHg (Cal.)
• Flash point: 278.4°C (Cal.)