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Sodium N-Lauroylglutamate
CAS: 29923-31-7 | C17H31NNaO5
2D Structure
3D Structure
Loading 3D structure...
Basic Information
CAS Registry Number:
29923-31-7
Molecular Formula:
C17H31NNaO5
Molecular Mass:
352.43 g/mol
Names and Synonyms:
Sodium N-Lauroylglutamate
L-Glutamic acid, N-(1-oxododecyl)-, sodium salt (1:1)
Corum 4060
Aminosurfact ALMS-P 1
ULS-30S
Aminosyl SLG
Glutamic acid, N-lauroyl-, monosodium salt, L-
L-Glutamic acid, N-(1-oxododecyl)-, monosodium salt
Sodium N-lauroyl-L-glutamate
Monosodium N-lauroyl-L-glutamate
N-Lauroyl-L-glutamic acid monosodium salt
Amisoft LS 11
LS 11
Acylglutamate LS 11
Sodium N-dodecanoylglutamate
Hostapon CLG
Sodium N-lauroylglutamate
N-Lauroyl-L-glutamic acid sodium salt
N-Dodecanoylglutamic acid sodium salt
N-Lauroylglutamic acid sodium salt
Amisoft LS 11(F)
Identifiers:
SMILES:
CCCCCCCCCCCC(O)=N[C@@H](CCC(=O)O)C(=O)O.[Na]
InChI:
InChI=1S/C17H31NO5.Na/c1-2-3-4-5-6-7-8-9-10-11-15(19)18-14(17(22)23)12-13-16(20)21;/h14H,2-13H2,1H3,(H,18,19)(H,20,21)(H,22,23);/t14-;/m0./s1
Spectral Data
NMR, IR, and Mass spectral data
1H NMR
13C NMR
Predicting NMR spectra...
10 ppm
9
8
7
6
5
4
3
2
1
0 ppm
| Shift (ppm) | Multiplicity | Integration | Assignment |
|---|
200 ppm
180
160
140
120
100
80
60
40
20
0 ppm
| Shift (ppm) | DEPT | Assignment |
|---|
Note: These NMR spectra are predicted computationally and may differ from experimental data. Predictions are based on chemical environment analysis.
All Properties
Comprehensive physical and chemical properties
| Property | Value | Source |
|---|---|---|
| Molecular Mass | 352.43 g/mol | CAS Common Chemistry |
| 352.427 g/mol | RDKit | |
| 352.209992372 g/mol | RDKit | |
| Canonical SMILES | [Na].O=C(O)CCC(NC(=O)CCCCCCCCCCC)C(=O)O | CAS Common Chemistry |
| InChI | InChI=1S/C17H31NO5.Na/c1-2-3-4-5-6-7-8-9-10-11-15(19)18-14(17(22)23)12-13-16(20)21;/h14H,2-13H2,1H3,(H,18,19)(H,20,21)(H,22,23);/t14-;/m0./s1 | CAS Common Chemistry |
| InChI Key | InChIKey=IRTMUORPUKFXOQ-UQKRIMTDSA-N | CAS Common Chemistry |
| Name | Sodium N-lauroylglutamate | CAS Common Chemistry |
| Heavy Atom Count | 24 | RDKit |
| Hydrogen Bond Acceptors | 3 | RDKit |
| Hydrogen Bond Donors | 3 | RDKit |
| Rotatable Bonds | 15 | RDKit |
| Aromatic Ring Count | 0 | RDKit |
| Topological Polar Surface Area | 107.19000000000001 Ų | RDKit |
| LogP | 3.801000000000001 | RDKit |
| Molar Refractivity | 95.95540000000007 | RDKit |
