Details of the Drug Inactive Ingredient (DIG)

General Information of DIG (ID: E0FC7K)
DIG Name
Cetyl ethylhexanoate
Synonyms    Click to Show/Hide the Synonyms of This DIG
Hexadecyl 2-ethylhexanoate; 59130-69-7; Cetyl 2-ethylhexanoate; Perceline oil; HEXANOIC ACID, 2-ETHYL-, HEXADECYL ESTER; cetyl ethylhexanoate; 90411-68-0; EINECS 261-619-1; Schercemol CO; Exceparl HO; Tegosoft CO; Cetearyl octanoate; Pelemol 168; Hest CSO (Salt/Mix); Crodamol CAP (Salt/Mix); EC 261-619-1; Tegosoft liquid (Salt/Mix); SCHEMBL15239; Lanol 1688 (Salt/Mix); 2-Ethylhexanoic acid cetyl ester; DTXSID20866741; 2-Ethylhexanoic acid, cetyl ester; AKOS028108429; BENZALDEHYDEPROPYLENEGLYCOLACETAL; DB11349; Hexanoic acid,2-ethyl-, C16-18-alkyl esters; Q27251471; Cetearyl Ethylhexanoate, Hexanoic acid, Hexadecyl ester, C16-18-alkyl esters
DIG Function
Emollient
PubChem CID
42956
Formula
C24H48O2
Canonical SMILES
CCCCCCCCCCCCCCCCOC(=O)C(CC)CCCC
InChI
1S/C24H48O2/c1-4-7-9-10-11-12-13-14-15-16-17-18-19-20-22-26-24(25)23(6-3)21-8-5-2/h23H,4-22H2,1-3H3
InChIKey
XJNUECKWDBNFJV-UHFFFAOYSA-N
   Click to Show/Hide the Molecular Data (Structure/Property) of This DIG
Structure
<iframe style="width: 300px; height: 300px;" frameborder="0" src="https://embed.molview.org/v1/?mode=balls&cid=42956"></iframe>
3D MOL is not available 2D MOL
Physicochemical Properties Molecular Weight 368.6 Topological Polar Surface Area 26.3
XlogP 10.7 Complexity 288
Heavy Atom Count 26 Rotatable Bond Count 21
Hydrogen Bond Donor Count 0 Hydrogen Bond Acceptor Count 2

If you find any error in data or bug in web service, please kindly report it to Dr. Zhang and Dr. Mou.