Cas no 26256-79-1 (N-(2-Carboxyethyl)-N-lauryl-beta-alanine)

N-(2-Carboxyethyl)-N-lauryl-beta-alanine structure
26256-79-1 structure
Product Name:N-(2-Carboxyethyl)-N-lauryl-beta-alanine
CAS No:26256-79-1
MF:C18H35NNaO4
MW:352.46457695961
CID:267550
Update Time:2023-08-02

N-(2-Carboxyethyl)-N-lauryl-beta-alanine Chemical and Physical Properties

Names and Identifiers

    • b-Alanine,N-(2-carboxyethyl)-N-dodecyl-, sodium salt (1:?)
    • 3,3'-(Dodecylimino)dipropionic acid, sodium salt
    • beta-Alanine, N-(2-carboxyethyl)-N-dodecyl-, sodium salt
    • N-(2-Carboxyethyl)-N-lauryl-beta-alanine
    • Inchi: 1S/C18H35NO4.Na/c1-2-3-4-5-6-7-8-9-10-11-14-19(15-12-17(20)21)16-13-18(22)23;/h2-16H2,1H3,(H,20,21)(H,22,23);/q;+1
    • InChI Key: LLKGTXLYJMUQJX-UHFFFAOYSA-N
    • SMILES: [Na+].OC(CCN(CCC(=O)O)CCCCCCCCCCCC)=O

Computed Properties

  • Hydrogen Bond Donor Count: 2
  • Hydrogen Bond Acceptor Count: 5
  • Heavy Atom Count: 24
  • Rotatable Bond Count: 17
  • Complexity: 289
  • Topological Polar Surface Area: 77.8
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