Cas no 10231-47-7 (2-Propen-1-ol, 3-(4-ethoxy-3-methoxyphenyl)-)
10231-47-7 structure
Product Name:2-Propen-1-ol, 3-(4-ethoxy-3-methoxyphenyl)-
CAS No:10231-47-7
MF:C12H16O3
MW:208.253643989563
CID:1134046
PubChem ID:71355791
Update Time:2025-04-20
2-Propen-1-ol, 3-(4-ethoxy-3-methoxyphenyl)- Chemical and Physical Properties
Names and Identifiers
-
- 2-Propen-1-ol, 3-(4-ethoxy-3-methoxyphenyl)-
- 3-(4-ethoxy-3-methoxyphenyl)prop-2-en-1-ol
- 10231-47-7
- (e)-3-(4-Ethoxy-3-methoxyphenyl)prop-2-en-1-ol
- AKOS017888067
- 4-ethoxy-3-methoxycinnamyl alcohol
- DTXSID10780048
-
- Inchi： 1S/C12H16O3/c1-3-15-11-7-6-10(5-4-8-13)9-12(11)14-2/h4-7,9,13H,3,8H2,1-2H3
- InChI Key： SXUDLOLGVBDXRL-UHFFFAOYSA-N
- SMILES： O(CC)C1C=CC(C=CCO)=CC=1OC
Computed Properties
- Exact Mass: 208.109944368g/mol
- Monoisotopic Mass: 208.109944368g/mol
- Isotope Atom Count: 0
- Hydrogen Bond Donor Count: 1
- Hydrogen Bond Acceptor Count: 3
- Heavy Atom Count: 15
- Rotatable Bond Count: 5
- Complexity: 191
- Covalently-Bonded Unit Count: 1
- Defined Atom Stereocenter Count: 0
- Undefined Atom Stereocenter Count : 0
- Defined Bond Stereocenter Count: 0
- Undefined Bond Stereocenter Count: 1
- XLogP3: 2
- Topological Polar Surface Area: 38.7?2
Experimental Properties
- PSA: 38.69000
- LogP: 2.09940
2-Propen-1-ol, 3-(4-ethoxy-3-methoxyphenyl)- Related Literature
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Ziyang Deng,Changwei Chen,Sunliang Cui RSC Adv., 2016,6, 93753-93755
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Yi Cao,Yujiao Xiahou,Lixiang Xing,Xiang Zhang,Hong Li,ChenShou Wu,Haibing Xia Nanoscale, 2020,12, 20456-20466
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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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A. B. F. da Silva,K. Capelle Phys. Chem. Chem. Phys., 2009,11, 4564-4569
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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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