Cas no 169250-31-1 (Ethanol, 2-(dihexadecylamino)-)
169250-31-1 structure
Product Name:Ethanol, 2-(dihexadecylamino)-
CAS No:169250-31-1
MF:C34H71NO
MW:509.933651208878
CID:1356214
PubChem ID:20160928
Update Time:2025-04-20
Ethanol, 2-(dihexadecylamino)- Chemical and Physical Properties
Names and Identifiers
-
- Ethanol, 2-(dihexadecylamino)-
- 2-(dihexadecylamino)ethanol
- DTXSID30603144
- 169250-31-1
- 2-dihexadecylamino-ethanol
- SCHEMBL1478275
- 2-(Dihexadecylamino)ethan-1-ol
-
- Inchi： 1S/C34H71NO/c1-3-5-7-9-11-13-15-17-19-21-23-25-27-29-31-35(33-34-36)32-30-28-26-24-22-20-18-16-14-12-10-8-6-4-2/h36H,3-34H2,1-2H3
- InChI Key： BUVABRXBEWFAPX-UHFFFAOYSA-N
- SMILES： OCCN(CCCCCCCCCCCCCCCC)CCCCCCCCCCCCCCCC
Computed Properties
- Exact Mass: 509.55393
- Monoisotopic Mass: 509.55356589g/mol
- Isotope Atom Count: 0
- Hydrogen Bond Donor Count: 1
- Hydrogen Bond Acceptor Count: 2
- Heavy Atom Count: 36
- Rotatable Bond Count: 32
- Complexity: 340
- 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: 15.1
- Topological Polar Surface Area: 23.5?2
Experimental Properties
- PSA: 23.47
Ethanol, 2-(dihexadecylamino)- Related Literature
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Veluru Jagadeesh babu,Sesha Vempati RSC Adv., 2015,5, 66367-66375
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Alexandre Vimont,Arnaud Travert,Philippe Bazin,Jean-Claude Lavalley,Marco Daturi,Christian Serre,Gérard Férey,Sandrine Bourrelly,Philip L. Llewellyn Chem. Commun., 2007, 3291-3293
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Zhixia Liu,Tingjian Chen,Floyd E. Romesberg Chem. Sci., 2017,8, 8179-8182
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Qiyuan Wu,Shangmin Xiong,Peichuan Shen,Shen Zhao,Alexander Orlov Catal. Sci. Technol., 2015,5, 2059-2064
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