Cas no 80649-13-4 (1,3-Dioxepane, 4,7-dimethyl-2-methylene-)
80649-13-4 structure
Product Name:1,3-Dioxepane, 4,7-dimethyl-2-methylene-
CAS No:80649-13-4
MF:C8H14O2
MW:142.195562839508
CID:1802289
PubChem ID:22475668
Update Time:2025-04-21
1,3-Dioxepane, 4,7-dimethyl-2-methylene- Chemical and Physical Properties
Names and Identifiers
-
- 1,3-Dioxepane, 4,7-dimethyl-2-methylene-
- 4,7-dimethyl-2-methylidene-1,3-dioxepane
- DTXSID90625923
- 80649-13-4
- SCHEMBL4365428
-
- Inchi： 1S/C8H14O2/c1-6-4-5-7(2)10-8(3)9-6/h6-7H,3-5H2,1-2H3
- InChI Key： YRIZQBRESDQTOJ-UHFFFAOYSA-N
- SMILES： O1C(=C)OC(C)CCC1C
Computed Properties
- Exact Mass: 142.099379685g/mol
- Monoisotopic Mass: 142.099379685g/mol
- Isotope Atom Count: 0
- Hydrogen Bond Donor Count: 0
- Hydrogen Bond Acceptor Count: 2
- Heavy Atom Count: 10
- Rotatable Bond Count: 0
- Complexity: 117
- 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: 2.4
- Topological Polar Surface Area: 18.5?2
1,3-Dioxepane, 4,7-dimethyl-2-methylene- Related Literature
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Jacob S. Jordan,Evan R. Williams Analyst, 2021,146, 2617-2625
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Xinhuan Wang,Shuangfei Cai,Cui Qi Analyst, 2017,142, 2500-2506
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Partha Laskar,Christine Dufès Nanoscale Adv., 2021,3, 6007-6026
-
Tao Wang,Yangyang Liu,Yue Deng,Hongbo Fu,Jianmin Chen Environ. Sci.: Nano, 2018,5, 1821-1833
-
Chung-Sung Yang,Mong-Shian Shih,Fang-Yi Chang New J. Chem., 2006,30, 729-735
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