Cas no 93776-95-5 (1H-3a,7-Methanoazulene,6-ethoxyoctahydro-3,6,8,8-tetramethyl-, (3R,3aS,6R,7R,8aS)-)
93776-95-5 structure
Product Name:1H-3a,7-Methanoazulene,6-ethoxyoctahydro-3,6,8,8-tetramethyl-, (3R,3aS,6R,7R,8aS)-
CAS No:93776-95-5
MF:C17H30O
MW:250.419505596161
CID:813481
PubChem ID:44147538
Update Time:2025-04-19
1H-3a,7-Methanoazulene,6-ethoxyoctahydro-3,6,8,8-tetramethyl-, (3R,3aS,6R,7R,8aS)- Chemical and Physical Properties
Names and Identifiers
-
- 1H-3a,7-Methanoazulene,6-ethoxyoctahydro-3,6,8,8-tetramethyl-, (3R,3aS,6R,7R,8aS)-
- [3R-(3alpha,3abeta,6alpha,7beta,8aalpha)]-6-ethoxyoctahydro-3,6,8,8-tetramethyl-1H-3a,7-methanoazulene
- 8-Ethoxycedrane
- 93776-95-5
- DTXSID60918091
- (3R-(3alpha,3abeta,6alpha,7beta,8aalpha))-6-Ethoxyoctahydro-3,6,8,8-tetramethyl-1H-3a,7-methanoazulene
- EINECS 298-023-6
-
- Inchi： 1S/C17H30O/c1-6-18-16(5)9-10-17-11-14(16)15(3,4)13(17)8-7-12(17)2/h12-14H,6-11H2,1-5H3/t12-,13+,14-,16-,17+/m1/s1
- InChI Key： YRQLWHMKOYODHC-QZCUMHFISA-N
- SMILES： O(CC)[C@]1(C)CC[C@]23[C@H](C)CC[C@H]2C(C)(C)[C@H]1C3
Computed Properties
- Exact Mass: 250.23
- Monoisotopic Mass: 250.23
- Isotope Atom Count: 0
- Hydrogen Bond Donor Count: 0
- Hydrogen Bond Acceptor Count: 1
- Heavy Atom Count: 18
- Rotatable Bond Count: 2
- Complexity: 348
- Covalently-Bonded Unit Count: 1
- Defined Atom Stereocenter Count: 5
- Undefined Atom Stereocenter Count : 0
- Defined Bond Stereocenter Count: 0
- Undefined Bond Stereocenter Count: 0
- Topological Polar Surface Area: 9.2A^2
- XLogP3: 4.8
1H-3a,7-Methanoazulene,6-ethoxyoctahydro-3,6,8,8-tetramethyl-, (3R,3aS,6R,7R,8aS)- Related Literature
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Zhixia Liu,Tingjian Chen,Floyd E. Romesberg Chem. Sci., 2017,8, 8179-8182
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Norihito Fukui,Keisuke Fujimoto,Hideki Yorimitsu,Atsuhiro Osuka Dalton Trans., 2017,46, 13322-13341
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Gerald J. Meyer,Leif Hammarstr?m Chem. Sci., 2020,11, 3460-3473
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Amit Kumar Majhi,Subbarao Kanchi,V. Venkataraman,K. G. Ayappa,Prabal K. Maiti Soft Matter, 2015,11, 8632-8640
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5. Fe3O4/Au/Fe3O4 nanoflowers exhibiting tunable saturation magnetization and enhanced bioconjugationFeng Shi,Kunping Yan,Mingli Peng,Xiao Cheng,Yanling Luo,Xuemei Chen,V. A. L. Roy,Zuankai Wang Nanoscale, 2012,4, 747-751
93776-95-5 (1H-3a,7-Methanoazulene,6-ethoxyoctahydro-3,6,8,8-tetramethyl-, (3R,3aS,6R,7R,8aS)-) Related Products
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