Cas no 52079-66-0 ((2S,4As,8aS)-1,2,3,4,4a,5,6,7,8,8a-decahydronaphthalen-2-ol)
52079-66-0 structure
Product Name:(2S,4As,8aS)-1,2,3,4,4a,5,6,7,8,8a-decahydronaphthalen-2-ol
CAS No:52079-66-0
MF:C10H18O
MW:154.249323368073
CID:2668781
Update Time:2023-08-06
(2S,4As,8aS)-1,2,3,4,4a,5,6,7,8,8a-decahydronaphthalen-2-ol Chemical and Physical Properties
Names and Identifiers
-
- (4aβ,8aα)-Decalin-2β-ol
- (4abeta,8aalpha)-Decalin-2beta-ol
- 2-Naphthalenol, decahydro-, [2S-(2.alpha.,4a.alpha.,8a.beta.)]
- (2S,4As,8aS)-1,2,3,4,4a,5,6,7,8,8a-decahydronaphthalen-2-ol
-
- Inchi： 1S/C10H18O/c11-10-6-5-8-3-1-2-4-9(8)7-10/h8-11H,1-7H2/t8-,9-,10-/m0/s1
- InChI Key： UPMAOXLCTXPPAG-GUBZILKMSA-N
- SMILES： O[C@H]1CC[C@@H]2CCCC[C@H]2C1
Computed Properties
- Hydrogen Bond Donor Count: 1
- Hydrogen Bond Acceptor Count: 1
- Heavy Atom Count: 11
- Rotatable Bond Count: 0
- Complexity: 133
- Topological Polar Surface Area: 20.2
(2S,4As,8aS)-1,2,3,4,4a,5,6,7,8,8a-decahydronaphthalen-2-ol Related Literature
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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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Olga Guselnikova,Gérard Audran,Jean-Patrick Joly,Andrii Trelin,Evgeny V. Tretyakov,Vaclav Svorcik,Oleksiy Lyutakov,Sylvain R. A. Marque Chem. Sci., 2021,12, 4154-4161
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Erika A. Cobar,Paul R. Horn,Robert G. Bergman,Martin Head-Gordon Phys. Chem. Chem. Phys., 2012,14, 15328-15339
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Brindha J.,Balamurali M. M.,Kaushik Chanda RSC Adv., 2019,9, 34720-34734
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Ross Harder,David C. Dunand,Ian McNulty Nanoscale, 2017,9, 5686-5693
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