Cas no 62099-13-2 (2-Propanone, 1-[2-(2-propenyl)phenoxy]-)
![2-Propanone, 1-[2-(2-propenyl)phenoxy]- structure](https://ossimg.kuujia.com/scimg/62500/62099-13-2x500.png)
62099-13-2 structure
Product Name:2-Propanone, 1-[2-(2-propenyl)phenoxy]-
CAS No:62099-13-2
MF:C12H14O2
MW:190.238363742828
CID:458152
PubChem ID:60772533
Update Time:2025-04-19
2-Propanone, 1-[2-(2-propenyl)phenoxy]- Chemical and Physical Properties
Names and Identifiers
-
- 2-Propanone, 1-[2-(2-propenyl)phenoxy]-
- 1-(2-prop-2-enylphenoxy)propan-2-one
- 62099-13-2
- 1-[2-(Prop-2-en-1-yl)phenoxy]propan-2-one
- SCHEMBL3312441
- DTXSID20734012
-
- Inchi： 1S/C12H14O2/c1-3-6-11-7-4-5-8-12(11)14-9-10(2)13/h3-5,7-8H,1,6,9H2,2H3
- InChI Key： ZTMNIDPAOPLWFY-UHFFFAOYSA-N
- SMILES： O(CC(C)=O)C1C=CC=CC=1CC=C
Computed Properties
- Exact Mass: 190.09942
- Monoisotopic Mass: 190.099379685g/mol
- Isotope Atom Count: 0
- Hydrogen Bond Donor Count: 0
- Hydrogen Bond Acceptor Count: 2
- Heavy Atom Count: 14
- Rotatable Bond Count: 5
- Complexity: 199
- 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
- Topological Polar Surface Area: 26.3?2
Experimental Properties
- PSA: 26.3
2-Propanone, 1-[2-(2-propenyl)phenoxy]- Related Literature
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Partha Laskar,Christine Dufès Nanoscale Adv., 2021,3, 6007-6026
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Norihito Fukui,Keisuke Fujimoto,Hideki Yorimitsu,Atsuhiro Osuka Dalton Trans., 2017,46, 13322-13341
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Chung-Sung Yang,Mong-Shian Shih,Fang-Yi Chang New J. Chem., 2006,30, 729-735
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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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Erika A. Cobar,Paul R. Horn,Robert G. Bergman,Martin Head-Gordon Phys. Chem. Chem. Phys., 2012,14, 15328-15339
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