Cas no 61871-64-5 (2-Propenoic acid, 3-(2-ethenylcyclopropyl)-, methyl ester, trans-)
61871-64-5 structure
Product Name:2-Propenoic acid, 3-(2-ethenylcyclopropyl)-, methyl ester, trans-
CAS No:61871-64-5
MF:C9H12O2
MW:152.190382957458
CID:464082
PubChem ID:71391515
Update Time:2025-04-19
2-Propenoic acid, 3-(2-ethenylcyclopropyl)-, methyl ester, trans- Chemical and Physical Properties
Names and Identifiers
-
- 2-Propenoic acid, 3-(2-ethenylcyclopropyl)-, methyl ester, trans-
- methyl 3-(2-ethenylcyclopropyl)prop-2-enoate
- DTXSID70813361
- 61871-64-5
-
- Inchi： 1S/C9H12O2/c1-3-7-6-8(7)4-5-9(10)11-2/h3-5,7-8H,1,6H2,2H3
- InChI Key： CITYGYUXZWAZMG-UHFFFAOYSA-N
- SMILES： O(C)C(C=CC1CC1C=C)=O
Computed Properties
- Exact Mass: 152.08376
- Monoisotopic Mass: 152.083729621g/mol
- Isotope Atom Count: 0
- Hydrogen Bond Donor Count: 0
- Hydrogen Bond Acceptor Count: 2
- Heavy Atom Count: 11
- Rotatable Bond Count: 4
- Complexity: 194
- Covalently-Bonded Unit Count: 1
- Defined Atom Stereocenter Count: 0
- Undefined Atom Stereocenter Count : 2
- Defined Bond Stereocenter Count: 0
- Undefined Bond Stereocenter Count: 1
- XLogP3: 1.8
- Topological Polar Surface Area: 26.3?2
Experimental Properties
- PSA: 26.3
2-Propenoic acid, 3-(2-ethenylcyclopropyl)-, methyl ester, trans- Related Literature
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Xin Fu,Qing-rong Liang,Rong-guang Luo,Yan-shu Li,Xiao-ping Xiao,Lu-lu Yu,Wen-zhe Shan,Guang-qin Fan J. Mater. Chem. B, 2019,7, 3088-3099
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Muniyandi Sankaralingam,So Hyun Jeon,Yong-Min Lee,Mi Sook Seo,Wonwoo Nam Dalton Trans., 2016,45, 376-383
-
S. Amaresh,K. Karthikeyan,K. J. Kim,Y. S. Lee RSC Adv., 2014,4, 23107-23115
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Huiying Xu,Lu Zheng,Yu Zhou,Bang-Ce Ye Analyst, 2021,146, 5542-5549
-
Hamid Heydari,Mohammad B. Gholivand New J. Chem., 2017,41, 237-244
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