Cas no 54411-61-9 (2-[(1S,2S,7R,10R,11S,13S,14S)-2,14-Dimethyl-13-tetracyclo[8.6.0.02,7.011,14]hexadecanyl]propan-2-ol)
![2-[(1S,2S,7R,10R,11S,13S,14S)-2,14-Dimethyl-13-tetracyclo[8.6.0.02,7.011,14]hexadecanyl]propan-2-ol structure](https://ossimg.kuujia.com/scimg/54500/54411-61-9x500.png)
54411-61-9 structure
Product Name:2-[(1S,2S,7R,10R,11S,13S,14S)-2,14-Dimethyl-13-tetracyclo[8.6.0.02,7.011,14]hexadecanyl]propan-2-ol
CAS No:54411-61-9
MF:C21H36O
MW:304.50994682312
CID:2670056
Update Time:2023-08-06
2-[(1S,2S,7R,10R,11S,13S,14S)-2,14-Dimethyl-13-tetracyclo[8.6.0.02,7.011,14]hexadecanyl]propan-2-ol Chemical and Physical Properties
Names and Identifiers
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- 20-Methyl-D(15)-nor-5α-pregnan-20-ol
- 2-[(1S,2S,7R,10R,11S,13S,14S)-2,14-Dimethyl-13-tetracyclo[8.6.0.02,7.011,14]hexadecanyl]propan-2-ol
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- Inchi： 1S/C21H36O/c1-19(2,22)18-13-17-15-9-8-14-7-5-6-11-20(14,3)16(15)10-12-21(17,18)4/h14-18,22H,5-13H2,1-4H3/t14-,15-,16+,17+,18-,20+,21+/m1/s1
- InChI Key： MTNYGAIVLYXPBL-IFQWWAKBSA-N
- SMILES： OC(C)(C)[C@H]1C[C@H]2[C@@H]3CC[C@H]4CCCC[C@]4(C)[C@H]3CC[C@@]21C
Computed Properties
- Hydrogen Bond Donor Count: 1
- Hydrogen Bond Acceptor Count: 1
- Heavy Atom Count: 22
- Rotatable Bond Count: 1
- Complexity: 455
- Topological Polar Surface Area: 20.2
2-[(1S,2S,7R,10R,11S,13S,14S)-2,14-Dimethyl-13-tetracyclo[8.6.0.02,7.011,14]hexadecanyl]propan-2-ol Related Literature
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Ivor Lon?ari? Phys. Chem. Chem. Phys., 2015,17, 9436-9445
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Huading Zhang,Lee R. Moore,Maciej Zborowski,P. Stephen Williams,Shlomo Margel,Jeffrey J. Chalmers Analyst, 2005,130, 514-527
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Liao Xiaoqing,Li Ruiyi,Li Zaijun,Sun Xiulan,Wang Zhouping,Liu Junkang New J. Chem., 2015,39, 5240-5248
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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
54411-61-9 (2-[(1S,2S,7R,10R,11S,13S,14S)-2,14-Dimethyl-13-tetracyclo[8.6.0.02,7.011,14]hexadecanyl]propan-2-ol) Related Products
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