Cas no 2649-70-9 (Kanokonol)
Kanokonol structure
Product Name:Kanokonol
CAS No:2649-70-9
MF:C15H26O2
MW:238.366307906429
CID:276634
Update Time:2024-02-29
Kanokonol Chemical and Physical Properties
Names and Identifiers
-
- 1(2H)-Naphthalenone,octahydro-4a-(hydroxymethyl)-8a-methyl-7-(1-methylethyl)-, (4aR,7R,8aR)-rel-
- 1(2H)-Naphthalenone, octahydro-4aa-(hydroxymethyl)-7b-isopropyl-8aa-methyl- (7CI,8CI)
- 1(2H)-Naphthalenone,octahydro-4a-(hydroxymethyl)-8a-methyl-7-(1-methylethyl)-, (4aa,7b,8aa)-
- Kanokonol
- 1(2H)-Naphthalenone, octahydro-4a-(hydroxymethyl)-8a-methyl-7-(1-methylethyl)-, (4aR,7R,8aR)-rel-
- 14-Hydroxyvaleranone
-
- Inchi： 1S/C15H26O2/c1-11(2)12-6-8-15(10-16)7-4-5-13(17)14(15,3)9-12/h11-12,16H,4-10H2,1-3H3/t12-,14+,15+/m1/s1
- InChI Key： SJKFIHGLULSUCA-SNPRPXQTSA-N
- SMILES： C1(=O)[C@@]2(C)[C@](CO)(CC[C@@H](C(C)C)C2)CCC1
Computed Properties
- Hydrogen Bond Donor Count: 1
- Hydrogen Bond Acceptor Count: 2
- Heavy Atom Count: 17
- XLogP3: 3.146
Kanokonol Related Literature
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Yong Ping Huang,Tao Tao,Zheng Chen,Wei Han,Ying Wu,Chunjiang Kuang,Shaoxiong Zhou,Ying Chen J. Mater. Chem. A, 2014,2, 18831-18837
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Shintaro Takata,Yoshihiro Miura Phys. Chem. Chem. Phys., 2014,16, 24784-24789
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Domenico Lombardo,Gianmarco Munaò,Pietro Calandra,Luigi Pasqua,Maria Teresa Caccamo Phys. Chem. Chem. Phys., 2019,21, 11983-11991
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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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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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