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Molecule
Glycol Distearate
CAS: 627-83-8 · C38H74O4
2D Structure
3D Structure
Loading 3D structure...
Basic Information
- CAS Registry Number
- 627-83-8
- Molecular Formula
- C38H74O4
- Molecular Mass
- 595.01 g/mol
Identifiers
CAS Registry Number
627-83-8
SMILES
CCCCCCCCCCCCCCCCCC(=O)OCCOC(=O)CCCCCCCCCCCCCCCCC
InChI Key
FPVVYTCTZKCSOJ-UHFFFAOYSA-N
InChI
InChI=1S/C38H74O4/c1-3-5-7-9-11-13-15-17-19-21-23-25-27-29-31-33-37(39)41-35-36-42-38(40)34-32-30-28-26-24-22-20-18-16-14-12-10-8-6-4-2/h3-36H2,1-2H3
Names and Synonyms
- Glycol Distearate Synonym
- Octadecanoic acid, 1,1′-(1,2-ethanediyl) ester Synonym
- Stearic acid, ethylene ester Synonym
- Octadecanoic acid, 1,2-ethanediyl ester Synonym
- Ethylene glycol, distearate Synonym
- Ethylene glycol, diester with stearic acid Synonym
- Ethylene distearate Synonym
- Ethylene stearate Synonym
- Elfan L 310 Synonym
- Ethylene glycol dioctadecanoate Synonym
- Ethylene dioctadecanoate Synonym
- Nissan Unister E 275 Synonym
- Emalex EG-diS Synonym
- Unister E 275 Synonym
- Emerest 2355 Synonym
- Cutina AGS Synonym
- Glycol distearate Synonym
- Emanon 3201M Synonym
- Glycolube 674 Synonym
- Cutina K 2-2747 Synonym
- Kemester EGDS Synonym
- Croda EGDS Synonym
- EGDS Synonym
- Kessco EGDS Synonym
- Pegosperse 50DS Synonym
- Pegnol EDS Synonym
- Empilan EGDS/A Synonym
- Santopearl GE 70 Synonym
- Emanon 3201 Synonym
- Tegin G 1100 Synonym
- Lipo EGDS Synonym
- NSC 6820 Synonym
- PK 3000AM Synonym
- Genapol PMS Synonym
- Mackester EGDS Synonym
- Tegin BL 315 Synonym
- B-DSP 60 Synonym
- Estepearl 15V Synonym
- Cithrol EGDS 3432 Synonym
- Emanon 3201MH-V Synonym
- Galaxy 610 Synonym
- Loxiol EP 237 Synonym
- Pegnol EDS 98K Synonym
- Tegin EGS Synonym
- Ethylene glycol distearate Synonym
- SS-Emalex EG-di-S Synonym
- DM 125H Synonym
- Emanon 3201M-V Synonym
- Estepearl 10V Synonym
- E 275 Synonym
All Properties
Comprehensive physical and chemical properties
| Property | Value | Source |
|---|---|---|
| Molecular Mass | 595.01 g/mol | CAS Common Chemistry |
| 595.0060000000002 g/mol | RDKit | |
| 595.006 g/mol | RDKit | |
| Density | 0.86 g/cm³ | CAS Common Chemistry |
| 0.8581 g/cm3 @ 78 °C | CAS Common Chemistry | |
| Wikipedia Url | https://en.wikipedia.org/wiki/Glycol_distearate | CAS Common Chemistry |
| Canonical SMILES | O=C(OCCOC(=O)CCCCCCCCCCCCCCCCC)CCCCCCCCCCCCCCCCC | CAS Common Chemistry |
| InChI | InChI=1S/C38H74O4/c1-3-5-7-9-11-13-15-17-19-21-23-25-27-29-31-33-37(39)41-35-36-42-38(40)34-32-30-28-26-24-22-20-18-16-14-12-10-8-6-4-2/h3-36H2,1-2H3 | CAS Common Chemistry |
| InChI Key | InChIKey=FPVVYTCTZKCSOJ-UHFFFAOYSA-N | CAS Common Chemistry |
| Melting Point | 79 °C | CAS Common Chemistry |
| Name | Glycol distearate | CAS Common Chemistry |
| Heavy Atom Count | 42 | RDKit |
| Hydrogen Bond Acceptors | 4 | RDKit |
| Hydrogen Bond Donors | 0 | RDKit |
| Rotatable Bonds | 35 | RDKit |
| Aromatic Ring Count | 0 | RDKit |
| Topological Polar Surface Area | 52.6 Ų | RDKit |
| LogP | 12.595799999999981 | RDKit |
| 12.5958 | RDKit | |
| 13.31 | chempirical lib | |
| Molar Refractivity | 181.00999999999945 cm³/mol | RDKit |
| Ring Count | 0 | RDKit |
| Formal Charge | 0 | RDKit |
| Fraction Csp3 | 0.9474 | RDKit |
| 0.95 | chempirical lib | |
| Exact Mass | 594.5587108479999 g/mol | RDKit |
Spectral Data
NMR, IR, and Mass spectral data
Predicting NMR spectra...
10 ppm
9
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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
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MW = 595.01 g/mol; density = 0.860 g/mL. Edit any field — others recompute live.
