Back to Search
Molecule
Triethanolamine Lauryl Sulfate
CAS: 139-96-8 · C18H41NO7S
2D Structure
3D Structure
Loading 3D structure...
Basic Information
- CAS Registry Number
- 139-96-8
- Molecular Formula
- C18H41NO7S
- Molecular Mass
- 415.59 g/mol
Identifiers
CAS Registry Number
139-96-8
SMILES
CCCCCCCCCCCCOS(=O)(=O)O.OCCN(CCO)CCO
InChI Key
JZKFHQMONDVVNF-UHFFFAOYSA-N
InChI
InChI=1S/C12H26O4S.C6H15NO3/c1-2-3-4-5-6-7-8-9-10-11-12-16-17(13,14)15;8-4-1-7(2-5-9)3-6-10/h2-12H2,1H3,(H,13,14,15);8-10H,1-6H2
Names and Synonyms
- Triethanolamine Lauryl Sulfate Common Name
- Sulfuric acid, monododecyl ester, compd. with 2,2′,2′′-nitrilotris[ethanol] (1:1) Synonym
- Sulfuric acid, monododecyl ester, compd. with 2,2′,2′′-nitrilotriethanol (1:1) Synonym
- Dodecyl sulfate, C12H25SO4H, compd. with 2,2′,2′′-nitrilotriethanol Synonym
- Ethanol, 2,2′,2′′-nitrilotri-, dodecyl sulfate (salt) Synonym
- Ethanol, 2,2′,2′′-nitrilotris-, dodecyl sulfate (salt) Synonym
- Dodecyl sulfate triethanolamine salt Synonym
- Drene Synonym
- Emal T Synonym
- Lauryl sulfate triethanolamine salt Synonym
- Maprofix TLS Synonym
- Propaste T Synonym
- Sipon LT Synonym
- Stepanol WAT Synonym
- Triethanolamine lauryl sulfate Synonym
- Sipon LT 6 Synonym
- Texapon TH Synonym
- Maprofix TLS 500 Synonym
- Triethanolammonium lauryl sulfate Synonym
- Triethanolamine dodecyl sulfate Synonym
- Standapol T Synonym
- Akyposal TLS Synonym
- Elfan 4240T Synonym
- Melanol LP 20T Synonym
- Cycloryl TAWF Synonym
- Steinapol TLS 40 Synonym
- Tylorol LT 50 Synonym
- Texapon T 35 Synonym
- Texapon T 42 Synonym
- Richonol T Synonym
- Maprofix TLS 65 Synonym
- Sterling WAT Synonym
- TEA-lauryl sulfate Synonym
- Rewopol TLS 40 Synonym
- Triethanolamine monododecyl sulfate Synonym
- Sipon LT 40 Synonym
- Laurylsulfuric acid triethanolamine salt Synonym
- Sulfetal LT Synonym
- Lauryl sulfate ester triethanolamine salt Synonym
- Sulfuric acid monododecyl ester triethanolamine salt Synonym
- Emal TD Synonym
- Sulfuric acid monolauryl ester triethanolamine salt Synonym
- Sulfetal KT 400 Synonym
- Triethanolammonium dodecyl sulfate Synonym
- Nikkol TEALS Synonym
- TEA dodecyl sulfate Synonym
- Perlankrol ATL 40 Synonym
- Cycloryl WAT Synonym
- Conco Sulfate TL Synonym
- Emal TD-L Synonym
- Empicol TL 40T Synonym
- Genapol LRT 40 Synonym
- Sapanol AT Synonym
- DeSulf TLS 40 Synonym
- Alscoap TL 40T Synonym
- Nissan Persoft SFT Synonym
- Carsonol TLS Synonym
- Persoft SFT Synonym
- Norfox TLS Synonym
- Nikkol TEALS 42 Synonym
- Alscoap NM 40T Synonym
- Sinolin TP Synonym
- Sandet LTD Synonym
- Taipol NLT 42 Synonym
- Ultrafax TLS Synonym
- Alscoap LS 40T Synonym
- Tipole NLT 42 Synonym
All Properties
Comprehensive physical and chemical properties
| Property | Value | Source |
|---|---|---|
| Molecular Mass | 415.59 g/mol | CAS Common Chemistry |
| 415.59300000000025 g/mol | RDKit | |
| 415.593 g/mol | RDKit | |
| 415.586 g/mol | chempirical lib | |
| Canonical SMILES | O=S(=O)(O)OCCCCCCCCCCCC.OCCN(CCO)CCO | CAS Common Chemistry |
| InChI | InChI=1S/C12H26O4S.C6H15NO3/c1-2-3-4-5-6-7-8-9-10-11-12-16-17(13,14)15;8-4-1-7(2-5-9)3-6-10/h2-12H2,1H3,(H,13,14,15);8-10H,1-6H2 | CAS Common Chemistry |
| InChI Key | InChIKey=JZKFHQMONDVVNF-UHFFFAOYSA-N | CAS Common Chemistry |
| Name | Triethanolamine lauryl sulfate | CAS Common Chemistry |
| Heavy Atom Count | 27 | RDKit |
| Hydrogen Bond Acceptors | 7 | RDKit |
| Hydrogen Bond Donors | 4 | RDKit |
| Rotatable Bonds | 18 | RDKit |
| Aromatic Ring Count | 0 | RDKit |
| Topological Polar Surface Area | 127.53000000000002 Ų | RDKit |
| 127.53 Ų | RDKit | |
| LogP | 1.9920000000000004 | RDKit |
| 1.992 | RDKit | |
| Molar Refractivity | 107.04200000000007 cm³/mol | RDKit |
| Ring Count | 0 | RDKit |
| Formal Charge | 0 | RDKit |
| Fraction Csp3 | 1.0 | RDKit |
| Exact Mass | 415.260373652 g/mol | RDKit |
Spectral Data
NMR, IR, and Mass spectral data
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.
External Resources
Convert
Quick conversion
MW = 415.59 g/mol. Edit any field — others recompute live.
