Cas no 40632-70-0 (2-methyl-2-(6-methylhept-6-enyl)-1,3-dioxolane)
40632-70-0 structure
Product Name:2-methyl-2-(6-methylhept-6-enyl)-1,3-dioxolane
CAS No:40632-70-0
MF:C12H22O2
MW:198.301884174347
CID:925997
PubChem ID:11970498
Update Time:2025-04-19
2-methyl-2-(6-methylhept-6-enyl)-1,3-dioxolane Chemical and Physical Properties
Names and Identifiers
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- 2-methyl-2-(6-methylhept-6-enyl)-1,3-dioxolane
- 2-Methyl-2-(6-methyl-6-heptenyl)-1,3-dioxolane
- EINECS 255-014-1
- 40632-70-0
- NS00030823
- DEFCHNJPYHQGCT-UHFFFAOYSA-N
- DTXSID20193640
-
- Inchi： 1S/C12H22O2/c1-11(2)7-5-4-6-8-12(3)13-9-10-14-12/h1,4-10H2,2-3H3
- InChI Key： DEFCHNJPYHQGCT-UHFFFAOYSA-N
- SMILES： O1CCOC1(C)CCCCCC(=C)C
Computed Properties
- Exact Mass: 198.161979940g/mol
- Monoisotopic Mass: 198.161979940g/mol
- Isotope Atom Count: 0
- Hydrogen Bond Donor Count: 0
- Hydrogen Bond Acceptor Count: 2
- Heavy Atom Count: 14
- Rotatable Bond Count: 6
- Complexity: 181
- Covalently-Bonded Unit Count: 1
- Defined Atom Stereocenter Count: 0
- Undefined Atom Stereocenter Count : 0
- Defined Bond Stereocenter Count: 0
- Undefined Bond Stereocenter Count: 0
- XLogP3: 3.6
- Topological Polar Surface Area: 18.5?2
2-methyl-2-(6-methylhept-6-enyl)-1,3-dioxolane Related Literature
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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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Long Deng,Qian Zou,Biao Liu,Wenhui Ye,Chengfei Zhuo,Li Chen,Ze-Yuan Deng,Ya-Wei Fan,Jing Li Food Funct., 2018,9, 4234-4245
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Denis V. Korchagin,Elena A. Yureva,Alexander V. Akimov,Eugenii Ya. Misochko,Gennady V. Shilov,Artem D. Talantsev,Roman B. Morgunov,Alexander A. Shakin,Sergey M. Aldoshin,Boris S. Tsukerblat Dalton Trans., 2017,46, 7540-7548
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Eunju Nam,Jiyeon Han,Sunhee Choi,Mi Hee Lim Chem. Commun., 2021,57, 7637-7640
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Max Attwood,Hiroki Akutsu,Lee Martin,Toby J. Blundell,Pierre Le Maguere,Scott S. Turner Dalton Trans., 2021,50, 11843-11851
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