Cas no 90316-04-4 (2,8-Decadien-5-ol, 6-ethenyl-5-ethynyl-2,6,9-trimethyl-)
90316-04-4 structure
Product Name:2,8-Decadien-5-ol, 6-ethenyl-5-ethynyl-2,6,9-trimethyl-
CAS No:90316-04-4
MF:C17H26O
MW:246.387745380402
CID:789421
PubChem ID:71429246
Update Time:2025-04-19
2,8-Decadien-5-ol, 6-ethenyl-5-ethynyl-2,6,9-trimethyl- Chemical and Physical Properties
Names and Identifiers
-
- 2,8-Decadien-5-ol, 6-ethenyl-5-ethynyl-2,6,9-trimethyl-
- 6-ethenyl-5-ethynyl-2,6,9-trimethyldeca-2,8-dien-5-ol
- 90316-04-4
- DTXSID20847939
-
- Inchi： 1S/C17H26O/c1-8-16(7,12-10-14(3)4)17(18,9-2)13-11-15(5)6/h2,8,10-11,18H,1,12-13H2,3-7H3
- InChI Key： GWJAUSRIBGUIBD-UHFFFAOYSA-N
- SMILES： OC(C#C)(C/C=C(\C)/C)C(C=C)(C)C/C=C(\C)/C
Computed Properties
- Exact Mass: 246.198365449g/mol
- Monoisotopic Mass: 246.198365449g/mol
- Isotope Atom Count: 0
- Hydrogen Bond Donor Count: 1
- Hydrogen Bond Acceptor Count: 1
- Heavy Atom Count: 18
- Rotatable Bond Count: 7
- Complexity: 397
- Covalently-Bonded Unit Count: 1
- Defined Atom Stereocenter Count: 0
- Undefined Atom Stereocenter Count : 2
- Defined Bond Stereocenter Count: 0
- Undefined Bond Stereocenter Count: 0
- XLogP3: 4.9
- Topological Polar Surface Area: 20.2?2
2,8-Decadien-5-ol, 6-ethenyl-5-ethynyl-2,6,9-trimethyl- Related Literature
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Shaun D. Wong,Edward I. Solomon Dalton Trans., 2014,43, 17567-17577
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Ana G. Neo,Ana Bornadiego,Jesús Díaz,Stefano Marcaccini,Carlos F. Marcos Org. Biomol. Chem., 2013,11, 6546-6555
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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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Domenico Lombardo,Gianmarco Munaò,Pietro Calandra,Luigi Pasqua,Maria Teresa Caccamo Phys. Chem. Chem. Phys., 2019,21, 11983-11991
90316-04-4 (2,8-Decadien-5-ol, 6-ethenyl-5-ethynyl-2,6,9-trimethyl-) Related Products
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