| General Information of DIG (ID: E0F7YE) |
| DIG Name |
Ethylhexyl hydroxystearate
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| Synonyms |
Click to Show/Hide the Synonyms of This DIG
2-Ethylhexyl 12-hydroxyoctadecanoate; 29710-25-6; 2-Ethylhexyl 12-hydroxystearate; Octadecanoic acid, 12-hydroxy-, 2-ethylhexyl ester; UNII-B7I80BVV5E; B7I80BVV5E; ETHYLHEXYL HYDROXYSTEARATE; 29383-26-4; 2-Ethylhexyl hydroxystearate; EINECS 249-793-7; Octadecanoic acid,12-hydroxy-, 2-ethylhexyl ester; 2-Ethylhexyl 12-hydroxy octadecanoate; 2-Ethylhexyl oxystearate; Octadecanoic acid, hydroxy-, 2-ethylhexyl ester; SCHEMBL4173514; DTXSID70865507; 12-Hydroxyoctadecanoic acid 2-ethylhexyl ester; 12-Hydroxyoctadecanoic acid, 2-ethylhexyl ester; W-110762; Q27274466
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| DIG Function |
Emollient
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| PubChem CID |
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| Formula |
C26H52O3
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| Canonical SMILES |
CCCCCCC(CCCCCCCCCCC(=O)OCC(CC)CCCC)O
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| InChI |
1S/C26H52O3/c1-4-7-9-16-20-25(27)21-17-14-12-10-11-13-15-18-22-26(28)29-23-24(6-3)19-8-5-2/h24-25,27H,4-23H2,1-3H3
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| InChIKey |
GLCFQKXOQDQJFZ-UHFFFAOYSA-N
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Click to Show/Hide the Molecular Data (Structure/Property) of This DIG
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| Structure |
<iframe style="width: 300px; height: 300px;" frameborder="0" src="https://embed.molview.org/v1/?mode=balls&cid=5463971"></iframe>
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3D MOL is not available
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2D MOL
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| Physicochemical Properties |
Molecular Weight |
412.7 |
Topological Polar Surface Area |
46.5 |
| XlogP |
9.8 |
Complexity |
343 |
| Heavy Atom Count |
29 |
Rotatable Bond Count |
23 |
| Hydrogen Bond Donor Count |
1 |
Hydrogen Bond Acceptor Count |
3 |
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