Back to Search
Molecule
Glyceryl Stearate
CAS: 11099-07-3 · C21H44O5
2D Structure
3D Structure
Loading 3D structure...
Basic Information
- CAS Registry Number
- 11099-07-3
- Molecular Formula
- C21H44O5
- Molecular Mass
- 376.58 g/mol
Identifiers
CAS Registry Number
11099-07-3
SMILES
CCCCCCCCCCCCCCCCCC(=O)O.OCC(O)CO
InChI Key
CKQVRZJOMJRTOY-UHFFFAOYSA-N
InChI
InChI=1S/C18H36O2.C3H8O3/c1-2-3-4-5-6-7-8-9-10-11-12-13-14-15-16-17-18(19)20;4-1-3(6)2-5/h2-17H2,1H3,(H,19,20);3-6H,1-2H2
Names and Synonyms
- Glyceryl Stearate Common Name
- Octadecanoic acid, ester with 1,2,3-propanetriol Synonym
- Stearin Synonym
- Glycerin stearic acid ester Synonym
- Glycerol stearate Synonym
- Margamuls Synonym
- Octadecanoic acid glycerol ester Synonym
- Glycerol stearic acid ester Synonym
- T 4 (glyceride) Synonym
- T 4 Synonym
- Tegin 515 Synonym
- Vinlub Synonym
- Atmul P 40S Synonym
- Atmul 124 Synonym
- Atmer 122 Synonym
- Glyceryl stearate Synonym
- Rikemal S 200 Synonym
- EG 11 Synonym
- Tegin special Synonym
- Tegomuls 90S Synonym
- Rikemal S 200P Synonym
- Atmos 150 Synonym
- Polynol Synonym
- Emulgator C Synonym
- Precirol Special WL 2155 Synonym
- Stearine Synonym
- AM 111 (surfactant) Synonym
- AM 113 Synonym
- AM 112 Synonym
- AM 111 Synonym
- Excel 150 Synonym
- Lexemul 515 Synonym
- Lexemul 530 Synonym
- Sunsoft 30 Synonym
- Atmer 123 Synonym
- Glycerin stearate Synonym
- Precirol WL 2155 Synonym
- Poem S 200 Synonym
- Tegomuls 4100 Synonym
- Pationic 1052K Synonym
- Pationic 1052 Synonym
- Kemester 6000 Synonym
- Monomuls 90S18 Synonym
- Estol 1461 Synonym
- Safacid 16/18AM Synonym
- Safacid 16/18MS Synonym
- Pristerene 4913 Synonym
- Rylo MD 50 Synonym
- Cutina MD Synonym
- S 200 Synonym
- S 95 Synonym
- Rikemal S 95 Synonym
- GMS-SE Synonym
- Stepan GMS S.E Synonym
- Estol 1462 Synonym
- Nikkol MGS-F 40 Synonym
- Dracorin GMS Synonym
- Dub GMS Synonym
- Witconol MST Synonym
- Monogrol Synonym
- Lasemul 92N40 Synonym
- Emalex GMS-F Synonym
- Atmul 67 Synonym
- Pristerene 4931 Synonym
- Poem S 95 Synonym
- Cadenax GS 90 Synonym
- Imwitor 800 Synonym
- Geleol Synonym
- Nikkol MGS-F 75V Synonym
- Lasemul 92AE Synonym
- Excel P 95 Synonym
- MGS-ASEV Synonym
- Rita GMS Synonym
- Nikkol MGS-BV 2 Synonym
- Hard Palm Stearin Synonym
- OLML Synonym
- Nikkol GMS-BV 2 Synonym
- MSD 608 Synonym
- Greenfad 2800SE Synonym
All Properties
Comprehensive physical and chemical properties
| Property | Value | Source |
|---|---|---|
| Molecular Mass | 376.58 g/mol | CAS Common Chemistry |
| 376.57800000000003 g/mol | RDKit | |
| 376.578 g/mol | RDKit | |
| Canonical SMILES | O=C(O)CCCCCCCCCCCCCCCCC.OCC(O)CO | CAS Common Chemistry |
| InChI | InChI=1S/C18H36O2.C3H8O3/c1-2-3-4-5-6-7-8-9-10-11-12-13-14-15-16-17-18(19)20;4-1-3(6)2-5/h2-17H2,1H3,(H,19,20);3-6H,1-2H2 | CAS Common Chemistry |
| InChI Key | InChIKey=CKQVRZJOMJRTOY-UHFFFAOYSA-N | CAS Common Chemistry |
| Melting Point | 60 °C | CAS Common Chemistry |
| Name | Glyceryl stearate | CAS Common Chemistry |
| Heavy Atom Count | 26 | RDKit |
| Hydrogen Bond Acceptors | 4 | RDKit |
| Hydrogen Bond Donors | 4 | RDKit |
| Rotatable Bonds | 18 | RDKit |
| Aromatic Ring Count | 0 | RDKit |
| Topological Polar Surface Area | 97.99000000000001 Ų | RDKit |
| 97.99 Ų | RDKit | |
| LogP | 4.664400000000006 | RDKit |
| 4.6644 | RDKit | |
| Molar Refractivity | 107.36020000000008 cm³/mol | RDKit |
| Ring Count | 0 | RDKit |
| Formal Charge | 0 | RDKit |
| Fraction Csp3 | 0.9524 | RDKit |
| 0.95 | chempirical lib | |
| Exact Mass | 376.3188745079999 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 = 376.58 g/mol. Edit any field — others recompute live.
