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Molecule
Lauryldimethylamine
CAS: 112-18-5 · C14H31N
2D Structure
3D Structure
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Basic Information
- CAS Registry Number
- 112-18-5
- Molecular Formula
- C14H31N
- Molecular Mass
- 213.41 g/mol
Identifiers
CAS Registry Number
112-18-5
SMILES
CCCCCCCCCCCCN(C)C
InChI Key
YWFWDNVOPHGWMX-UHFFFAOYSA-N
InChI
InChI=1S/C14H31N/c1-4-5-6-7-8-9-10-11-12-13-14-15(2)3/h4-14H2,1-3H3
Names and Synonyms
- Lauryldimethylamine Common Name
- 1-Dodecanamine, N,N-dimethyl- Synonym
- Dodecylamine, N,N-dimethyl- Synonym
- N,N-Dimethyl-1-dodecanamine Synonym
- RC 5629 Synonym
- N,N-Dimethyldodecylamine Synonym
- Dodecyldimethylamine Synonym
- DDA Synonym
- N,N-Dimethyllaurylamine Synonym
- Monolauryl dimethylamine Synonym
- Lauryldimethylamine Synonym
- N-Lauryldimethylamine Synonym
- N-Dodecyldimethylamine Synonym
- Armeen DM 12D Synonym
- N,N-Dimethyl-n-dodecylamine Synonym
- DDA (corrosion inhibitor) Synonym
- Antioxidant DDA Synonym
- N-Dodecyl-N,N-dimethylamine Synonym
- Farmin DM 20 Synonym
- (Dimethylamino)dodecane Synonym
- IPL 12 Synonym
- Empigen AB Synonym
- Adma 12 Synonym
- Genamin LA 302D Synonym
- Farmin DM 2098 Synonym
- NSC 7332 Synonym
- Barlene 12S Synonym
- Toyocat D 60 Synonym
- Nissan Tertiary Amine BB Synonym
- DM 2098 Synonym
- 1-Dimethylaminododecane Synonym
- Lipomin DM 12D Synonym
All Properties
Comprehensive physical and chemical properties
| Property | Value | Source |
|---|---|---|
| Molecular Mass | 213.41 g/mol | CAS Common Chemistry |
| 213.40899999999996 g/mol | RDKit | |
| 213.409 g/mol | RDKit | |
| Boiling Point | 260 °C | CAS Common Chemistry |
| Canonical SMILES | N(C)(C)CCCCCCCCCCCC | CAS Common Chemistry |
| InChI | InChI=1S/C14H31N/c1-4-5-6-7-8-9-10-11-12-13-14-15(2)3/h4-14H2,1-3H3 | CAS Common Chemistry |
| InChI Key | InChIKey=YWFWDNVOPHGWMX-UHFFFAOYSA-N | CAS Common Chemistry |
| Melting Point | 22 °C | CAS Common Chemistry |
| Name | Lauryldimethylamine | CAS Common Chemistry |
| Heavy Atom Count | 15 | RDKit |
| Hydrogen Bond Acceptors | 1 | RDKit |
| Hydrogen Bond Donors | 0 | RDKit |
| Rotatable Bonds | 11 | RDKit |
| Aromatic Ring Count | 0 | RDKit |
| Topological Polar Surface Area | 3.24 Ų | RDKit |
| 3.01 Ų | chempirical lib | |
| LogP | 4.468900000000004 | RDKit |
| 4.4689 | RDKit | |
| Molar Refractivity | 70.39800000000007 cm³/mol | RDKit |
| Ring Count | 0 | RDKit |
| Formal Charge | 0 | RDKit |
| Fraction Csp3 | 1.0 | RDKit |
| Exact Mass | 213.24564999199998 g/mol | RDKit |
Spectral Data
NMR, IR, and Mass spectral data
Predicting NMR spectra...
10 ppm
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1
0 ppm
| Shift (ppm) | Multiplicity | Integration | Assignment |
|---|
200 ppm
180
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20
0 ppm
| Shift (ppm) | DEPT | Assignment |
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Note: These NMR spectra are predicted computationally and may differ from experimental data. Predictions are based on chemical environment analysis.
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MW = 213.41 g/mol. Edit any field — others recompute live.
Related
Related molecules
Other compounds with formula C14H31N.
