Cas no 69659-93-4 (6,10-Dodecadienal,3,7,11-trimethyl-, (6E)-)
69659-93-4 structure
Product Name:6,10-Dodecadienal,3,7,11-trimethyl-, (6E)-
CAS No:69659-93-4
MF:C15H26O
MW:222.366344928741
CID:509269
Update Time:2024-01-30
6,10-Dodecadienal,3,7,11-trimethyl-, (6E)- Chemical and Physical Properties
Names and Identifiers
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- 6,10-Dodecadienal,3,7,11-trimethyl-, (6E)-
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- Inchi： 1S/C15H26O/c1-13(2)7-5-8-14(3)9-6-10-15(4)11-12-16/h7,9,12,15H,5-6,8,10-11H2,1-4H3/b14-9+
- InChI Key： ITBYWGRSPHMAEE-NTEUORMPSA-N
- SMILES： C(=O)CC(C)CC/C=C(\C)/CC/C=C(/C)\C
Computed Properties
- Exact Mass: 222.198365
- Monoisotopic Mass: 222.198365
- Isotope Atom Count: 0
- Hydrogen Bond Donor Count: 0
- Hydrogen Bond Acceptor Count: 1
- Heavy Atom Count: 16
- Rotatable Bond Count: 8
- Complexity: 244
- Covalently-Bonded Unit Count: 1
- Defined Atom Stereocenter Count: 0
- Undefined Atom Stereocenter Count : 1
- Defined Bond Stereocenter Count: 1
- Undefined Bond Stereocenter Count: 0
- Topological Polar Surface Area: 17.1
Experimental Properties
- Density: 0.853
- Boiling Point: 309.5°Cat760mmHg
- Flash Point: 146.4°C
6,10-Dodecadienal,3,7,11-trimethyl-, (6E)- Related Literature
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Saeideh Mirfakhraei,Malak Hekmati,Fereshteh Hosseini Eshbala,Hojat Veisi New J. Chem., 2018,42, 1757-1761
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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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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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Bruce Parkinson Energy Environ. Sci., 2010,3, 509-511
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Yukiya Kitayama Polym. Chem., 2014,5, 2784-2792
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