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Lauric Acid Monoethanolamide
CAS: 142-78-9 | C14H29NO2
2D Structure
3D Structure
Loading 3D structure...
Basic Information
CAS Registry Number:
142-78-9
Molecular Formula:
C14H29NO2
Molecular Weight:
243.39099999999996 g/mol
Names and Synonyms:
Lauric Acid Monoethanolamide
Copramyl
N-(2-Hydroxyethyl)dodecanamide
Dodecanamide, N-(2-hydroxyethyl)-
N 120
Mackamide LMA
Lauric acid N-(2-hydroxyethyl)amide
Aminon C 01S
Aminon C 01
Lauramide monoethanolamine
Tohol N 230
Mackamide LMM
Alkamide L 203
N-Lauroylethanolamine
Tohol N 120
N-(β-Hydroxyethyl)dodecanamide
N-Dodecanoylethanolamine
Amisol LME
Lauric N-(2-hydroxyethyl)amide
Rolamid CM
Comperlan LM
Lauroyl monoethanolamide
Lauramide MEA
Rewomid L 203
Cyclomide LM
Lauric acid monoethanolamine
Steinamid L 203
Lauridit LM
Lauric monoethanolamide
Vistalan
Lauric acid monoethanolamide
Ultrapole H
Stabilor CMH
Lauryl monoethanolamide
Laurylethanolamide
Laurylamidoethanol
Lauric ethylolamide
Lauric acid ethanolamide
N-(2-Hydroxyethyl)lauramide
2-Dodecanamidoethanol
Crillon LME
Identifiers:
SMILES:
CCCCCCCCCCCC(O)=NCCO
InChI:
InChI=1S/C14H29NO2/c1-2-3-4-5-6-7-8-9-10-11-14(17)15-12-13-16/h16H,2-13H2,1H3,(H,15,17)
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
Physical Properties
| Property | Value | Source |
|---|---|---|
| molecular_mass | 243.39 g/mol | Legacy Database |
| cas-canonical-smile | O=C(NCCO)CCCCCCCCCCC None | Legacy Database |
| cas-inchi | InChI=1S/C14H29NO2/c1-2-3-4-5-6-7-8-9-10-11-14(17)15-12-13-16/h16H,2-13H2,1H3,(H,15,17) None | Legacy Database |
| cas-inchi-key | InChIKey=QZXSMBBFBXPQHI-UHFFFAOYSA-N None | Legacy Database |
| cas-melting-point | 62 °C None | Legacy Database |
| cas-name | Lauric acid monoethanolamide None | Legacy Database |
| LogP | 3.8561000000000027 | RDKit |
Molecular
| Property | Value | Source |
|---|---|---|
| Molecular Weight | 243.39099999999996 g/mol | RDKit |
Exact
| Property | Value | Source |
|---|---|---|
| Exact Molecular Weight | 243.219829168 g/mol | RDKit |
Heavy
| Property | Value | Source |
|---|---|---|
| Heavy Atom Count | 17 count | RDKit |
Hydrogen
| Property | Value | Source |
|---|---|---|
| Hydrogen Bond Acceptors | 2 count | RDKit |
| Hydrogen Bond Donors | 2 count | RDKit |
Rotatable
| Property | Value | Source |
|---|---|---|
| Rotatable Bonds | 12 count | RDKit |
Aromatic
| Property | Value | Source |
|---|---|---|
| Aromatic Ring Count | 0 count | RDKit |
Topological
| Property | Value | Source |
|---|---|---|
| Topological Polar Surface Area | 52.82000000000001 Ų | RDKit |
Molar
| Property | Value | Source |
|---|---|---|
| Molar Refractivity | 73.86060000000005 | RDKit |
