Cas no 6960-51-6 (2,3,4,5,6-pentahydroxyhexanoic Acid, Tetradecan-1-amine)
6960-51-6 structure
Product Name:2,3,4,5,6-pentahydroxyhexanoic Acid, Tetradecan-1-amine
CAS No:6960-51-6
MF:C20H43NO7
MW:409.557927370071
CID:973911
PubChem ID:236990
Update Time:2025-04-19
2,3,4,5,6-pentahydroxyhexanoic Acid, Tetradecan-1-amine Chemical and Physical Properties
Names and Identifiers
-
- 2,3,4,5,6-pentahydroxyhexanoic Acid, Tetradecan-1-amine
- Tetradecan-1-amine--hexonic acid (1/1)
- NSC-40147
- 6960-51-6
- DTXSID40989688
- NSC40147
-
- Inchi： 1S/C14H31N.C6H12O7/c1-2-3-4-5-6-7-8-9-10-11-12-13-14-15;7-1-2(8)3(9)4(10)5(11)6(12)13/h2-15H2,1H3;2-5,7-11H,1H2,(H,12,13)
- InChI Key： BOESTNYOLIDOAZ-UHFFFAOYSA-N
- SMILES： OC(C(CO)O)C(C(C(=O)O)O)O.NCCCCCCCCCCCCCC
Computed Properties
- Exact Mass: 409.30409
- Monoisotopic Mass: 409.304
- Isotope Atom Count: 0
- Hydrogen Bond Donor Count: 7
- Hydrogen Bond Acceptor Count: 8
- Heavy Atom Count: 28
- Rotatable Bond Count: 17
- Complexity: 272
- Covalently-Bonded Unit Count: 2
- Defined Atom Stereocenter Count: 0
- Undefined Atom Stereocenter Count : 4
- Defined Bond Stereocenter Count: 0
- Undefined Bond Stereocenter Count: 0
- Topological Polar Surface Area: 165?2
Experimental Properties
- Boiling Point: 291.9°C at 760 mmHg
- Flash Point: 120.2°C
- PSA: 164.47
- LogP: 1.85340
2,3,4,5,6-pentahydroxyhexanoic Acid, Tetradecan-1-amine Related Literature
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Guang Xu,Wei Zhang,Ying Zhang,Xiaoxia Zhao,Ping Wen,Di Ma RSC Adv., 2018,8, 19353-19361
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Christopher B. Rodell,Christopher B. Highley,Minna H. Chen,Neville N. Dusaj,Chao Wang,Lin Han,Jason A. Burdick Soft Matter, 2016,12, 7839-7847
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Yukiya Kitayama Polym. Chem., 2014,5, 2784-2792
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Thi Thu Tram Nguyen,Thanh Binh Nguyen Org. Biomol. Chem., 2021,19, 6015-6020
6960-51-6 (2,3,4,5,6-pentahydroxyhexanoic Acid, Tetradecan-1-amine) Related Products
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