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Lauric Acid
CAS: 143-07-7 | C12H24O2
2D Structure
3D Structure
Loading 3D structure...
Basic Information
CAS Registry Number:
143-07-7
Molecular Formula:
C12H24O2
Molecular Weight:
200.32199999999997 g/mol
Names and Synonyms:
Lauric Acid
Common Name
NS 6
Synonym
Radiacid 0624
Synonym
Coconut Hard 42
Synonym
Coconut Hard 34
Synonym
Edenor C12-99
Synonym
D 97385
Synonym
Palmae 99-12
Synonym
Dodecanoates
Synonym
Laurates
Synonym
Lasacid FC 12
Synonym
Edenor C 12-98-100
Synonym
Palmera B 1231
Synonym
Edenor 12/98-100
Synonym
Palmac 98-12
Synonym
Imex C 1299
Synonym
1-Dodecanoic acid
Synonym
ContraZeck
Synonym
Prifrac 2920
Synonym
Edenor C 12
Synonym
Prifac 2922
Synonym
NAA 122
Synonym
NSC 5026
Synonym
Edenor C 1298-100
Synonym
Philacid 1200
Synonym
Kortacid 1299
Synonym
NAA 312
Synonym
Hystrene 9512
Synonym
Lunac L 98
Synonym
Nissan NAA 122
Synonym
Prifac 2920
Synonym
Emery 651
Synonym
Lunac L 70
Synonym
Neo-Fat 12
Synonym
n-Dodecanoic acid
Synonym
Neo-Fat 12-43
Synonym
Vulvic acid
Synonym
Dodecylic acid
Synonym
Univol U 314
Synonym
Aliphat No. 4
Synonym
ABL
Synonym
1-Undecanecarboxylic acid
Synonym
Laurostearic acid
Synonym
Lauric acid
Synonym
Dodecanoic acid
Synonym
Identifiers:
SMILES:
CCCCCCCCCCCC(=O)O
InChI:
InChI=1S/C12H24O2/c1-2-3-4-5-6-7-8-9-10-11-12(13)14/h2-11H2,1H3,(H,13,14)
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
Molecular
| Property | Value | Source |
|---|---|---|
| Molecular Weight | 200.32199999999997 g/mol | RDKit |
Exact
| Property | Value | Source |
|---|---|---|
| Exact Molecular Weight | 200.177630008 g/mol | RDKit |
Heavy
| Property | Value | Source |
|---|---|---|
| Heavy Atom Count | 14 count | RDKit |
Hydrogen
| Property | Value | Source |
|---|---|---|
| Hydrogen Bond Acceptors | 1 count | RDKit |
| Hydrogen Bond Donors | 1 count | RDKit |
Rotatable
| Property | Value | Source |
|---|---|---|
| Rotatable Bonds | 10 count | RDKit |
Aromatic
| Property | Value | Source |
|---|---|---|
| Aromatic Ring Count | 0 count | RDKit |
Topological
| Property | Value | Source |
|---|---|---|
| Topological Polar Surface Area | 37.3 Ų | RDKit |
Physical Properties
| Property | Value | Source |
|---|---|---|
| LogP | 3.991900000000002 | RDKit |
| molecular_mass | 200.32 g/mol | Legacy Database |
| density | 0.88 g/cm³ | Legacy Database |
| wikipedia_url | https://en.wikipedia.org/wiki/Lauric_acid None | Legacy Database |
| cas-boiling-point | 298.9 °C None | Legacy Database |
| cas-canonical-smile | O=C(O)CCCCCCCCCCC None | Legacy Database |
| cas-density | 0.883 g/cm3 @ Temp: 20 °C None | Legacy Database |
| cas-inchi | InChI=1S/C12H24O2/c1-2-3-4-5-6-7-8-9-10-11-12(13)14/h2-11H2,1H3,(H,13,14) None | Legacy Database |
| cas-inchi-key | InChIKey=POULHZVOKOAJMA-UHFFFAOYSA-N None | Legacy Database |
| cas-melting-point | 44.2 °C None | Legacy Database |
| cas-name | Lauric acid None | Legacy Database |
| wikipedia-name | Lauric acid None | Legacy Database |
Molar
| Property | Value | Source |
|---|---|---|
| Molar Refractivity | 59.47980000000005 | RDKit |