Cas no 30557-76-7 ((1R,5R,8R)-7,7-Dimethyl-6-methylidenetricyclo[6.2.1.01,5]undecan-2-one)
![(1R,5R,8R)-7,7-Dimethyl-6-methylidenetricyclo[6.2.1.01,5]undecan-2-one structure](https://ossimg.kuujia.com/scimg/31000/30557-76-7x500.png)
30557-76-7 structure
Product Name:(1R,5R,8R)-7,7-Dimethyl-6-methylidenetricyclo[6.2.1.01,5]undecan-2-one
CAS No:30557-76-7
MF:C14H20O
MW:204.308004379272
CID:317577
Update Time:2024-02-29
(1R,5R,8R)-7,7-Dimethyl-6-methylidenetricyclo[6.2.1.01,5]undecan-2-one Chemical and Physical Properties
Names and Identifiers
-
- 3H-3a,6-Methanoazulen-3-one,octahydro-7,7-dimethyl-8-methylene-, (3aR,6R,8aR)-
- 7,7-Dimethyl-8-methylene-1,2,4,5,6,7,8,8aα-octahydro-3H-3aα,6α-methanoazulene-3-one
- (-)-Khusimone
- 3H-3a,6-Methanoazulen-3-one,octahydro-7,7-dimethyl-8-methylene-, [3aR-(3aa,6a,8aa)]-
- 3H-3aa,6-Methanoazulen-3-one, 1,2,4,5,6b,7,8,8aa-octahydro-7,7-dimethyl-8-methylene-,(-)- (8CI)
- Khusimon
- Khusimone
- (1R,5R,8R)-7,7-Dimethyl-6-methylidenetricyclo[6.2.1.01,5]undecan-2-one
-
- Inchi： 1S/C14H20O/c1-9-11-4-5-12(15)14(11)7-6-10(8-14)13(9,2)3/h10-11H,1,4-8H2,2-3H3/t10-,11-,14-/m1/s1
- InChI Key： BDHSOIIDXCBNPA-JTNHKYCSSA-N
- SMILES： O=C1CC[C@@H]2C(=C)C(C)(C)[C@@H]3CC[C@@]21C3
Computed Properties
- Hydrogen Bond Donor Count: 0
- Hydrogen Bond Acceptor Count: 1
- Heavy Atom Count: 15
- Rotatable Bond Count: 0
- Complexity: 352
- Topological Polar Surface Area: 17.1
- XLogP3: 2.822
(1R,5R,8R)-7,7-Dimethyl-6-methylidenetricyclo[6.2.1.01,5]undecan-2-one Related Literature
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Jacob S. Jordan,Evan R. Williams Analyst, 2021,146, 2617-2625
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Norihito Fukui,Keisuke Fujimoto,Hideki Yorimitsu,Atsuhiro Osuka Dalton Trans., 2017,46, 13322-13341
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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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Gang Pan,Yi-jie Bao,Jie Xu,Tao Liu,Cheng Liu,Yan-yan Qiu,Xiao-jing Shi,Hui Yu,Ting-ting Jia,Xia Yuan,Ze-ting Yuan,Yi-jun Cao RSC Adv., 2016,6, 42109-42119
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