Cas no 14690-01-8 (2-Propanol,1,3-bis(hexadecyloxy)-)
14690-01-8 structure
Product Name:2-Propanol,1,3-bis(hexadecyloxy)-
CAS No:14690-01-8
MF:C35H72O3
MW:540.944392204285
CID:222497
PubChem ID:84596
Update Time:2025-04-19
2-Propanol,1,3-bis(hexadecyloxy)- Chemical and Physical Properties
Names and Identifiers
-
- 2-Propanol,1,3-bis(hexadecyloxy)-
- 1,3-Bis(hexadecyloxy)propan-2-ol
- 1,3-dihexadecoxypropan-2-ol
- Einecs 238-731-4
- 1-O,3-O-Dihexadecylglycerol
- 1,3-Bis(hexadecyloxy)-2-propanol
- 14690-01-8
- DTXSID40163542
- NS00024813
- CSTYETQXRJUWCP-UHFFFAOYSA-N
- SCHEMBL153185
- 1,3-dihexadecylglycerol
- 1,3-di-O-(n-hexadecyl)-glycerol
-
- Inchi： 1S/C35H72O3/c1-3-5-7-9-11-13-15-17-19-21-23-25-27-29-31-37-33-35(36)34-38-32-30-28-26-24-22-20-18-16-14-12-10-8-6-4-2/h35-36H,3-34H2,1-2H3
- InChI Key： CSTYETQXRJUWCP-UHFFFAOYSA-N
- SMILES： O(CC(COCCCCCCCCCCCCCCCC)O)CCCCCCCCCCCCCCCC
Computed Properties
- Exact Mass: 540.54846
- Monoisotopic Mass: 540.54814615g/mol
- Isotope Atom Count: 0
- Hydrogen Bond Donor Count: 1
- Hydrogen Bond Acceptor Count: 3
- Heavy Atom Count: 38
- Rotatable Bond Count: 34
- Complexity: 365
- Covalently-Bonded Unit Count: 1
- Defined Atom Stereocenter Count: 0
- Undefined Atom Stereocenter Count : 0
- Defined Bond Stereocenter Count: 0
- Undefined Bond Stereocenter Count: 0
- XLogP3: 14.8
- Topological Polar Surface Area: 38.7?2
Experimental Properties
- PSA: 38.69
2-Propanol,1,3-bis(hexadecyloxy)- Related Literature
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Waleed M. Hussein,Tzu-Yu Liu,Pirashanthini Maruthayanar,Saori Mukaida,Peter M. Moyle,James W. Wells,Istvan Toth,Mariusz Skwarczynski Chem. Sci. 2016 7 2308
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Frédéric Loosli,David Alonso Doval,David Grassi,Pierre-Léonard Zaffalon,France Favarger,Andreas Zumbuehl Chem. Commun. 2012 48 1604
14690-01-8 (2-Propanol,1,3-bis(hexadecyloxy)-) Related Products
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