Cas no 58509-30-1 (Benzene, 1-[(3,7-dimethyl-2,6-dodecadienyl)oxy]- 4-ethyl-)
![Benzene, 1-[(3,7-dimethyl-2,6-dodecadienyl)oxy]- 4-ethyl- structure](https://ossimg.kuujia.com/scimg/59000/58509-30-1x500.png)
58509-30-1 structure
Product Name:Benzene, 1-[(3,7-dimethyl-2,6-dodecadienyl)oxy]- 4-ethyl-
CAS No:58509-30-1
MF:C22H34O
MW:314.504766941071
CID:341835
PubChem ID:71443519
Update Time:2025-04-19
Benzene, 1-[(3,7-dimethyl-2,6-dodecadienyl)oxy]- 4-ethyl- Chemical and Physical Properties
Names and Identifiers
-
- Benzene, 1-[(3,7-dimethyl-2,6-dodecadienyl)oxy]- 4-ethyl-
- 1-(3,7-dimethyldodeca-2,6-dienoxy)-4-ethylbenzene
- 58509-30-1
- DTXSID40852343
- 1-[(3,7-DIMETHYLDODECA-2,6-DIEN-1-YL)OXY]-4-ETHYLBENZENE
-
- Inchi： 1S/C22H34O/c1-5-7-8-10-19(3)11-9-12-20(4)17-18-23-22-15-13-21(6-2)14-16-22/h11,13-17H,5-10,12,18H2,1-4H3
- InChI Key： OKMTWULWYHLBCF-UHFFFAOYSA-N
- SMILES： O(C1C=CC(=CC=1)CC)CC=C(C)CCC=C(C)CCCCC
Computed Properties
- Exact Mass: 314.26112
- Monoisotopic Mass: 314.260965704g/mol
- Isotope Atom Count: 0
- Hydrogen Bond Donor Count: 0
- Hydrogen Bond Acceptor Count: 1
- Heavy Atom Count: 23
- Rotatable Bond Count: 11
- Complexity: 345
- Covalently-Bonded Unit Count: 1
- Defined Atom Stereocenter Count: 0
- Undefined Atom Stereocenter Count : 0
- Defined Bond Stereocenter Count: 0
- Undefined Bond Stereocenter Count: 2
- XLogP3: 8.1
- Topological Polar Surface Area: 9.2?2
Experimental Properties
- PSA: 9.23
Benzene, 1-[(3,7-dimethyl-2,6-dodecadienyl)oxy]- 4-ethyl- Related Literature
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Shintaro Takata,Yoshihiro Miura Phys. Chem. Chem. Phys., 2014,16, 24784-24789
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Weili Dai,Guangjun Wu,Michael Hunger Chem. Commun., 2015,51, 13779-13782
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Maomao Hou,Fenglin Zhong,Qiu Jin,Enjiang Liu,Jie Feng,Tengyun Wang,Yue Gao RSC Adv., 2017,7, 34392-34400
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Thi Thu Tram Nguyen,Thanh Binh Nguyen Org. Biomol. Chem., 2021,19, 6015-6020
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