Cas no 157096-53-2 (2-Propenal,3-[4-(acetyloxy)phenyl]-, (2E)-)
![2-Propenal,3-[4-(acetyloxy)phenyl]-, (2E)- structure](https://ossimg.kuujia.com/scimg/157500/157096-53-2x500.png)
157096-53-2 structure
Product Name:2-Propenal,3-[4-(acetyloxy)phenyl]-, (2E)-
CAS No:157096-53-2
MF:C11H10O3
MW:190.195303440094
CID:138431
PubChem ID:11137923
Update Time:2025-04-19
2-Propenal,3-[4-(acetyloxy)phenyl]-, (2E)- Chemical and Physical Properties
Names and Identifiers
-
- 2-Propenal,3-[4-(acetyloxy)phenyl]-, (2E)-
- 2-PROPENAL, 3-(4-(ACETYLOXY)PHENYL)-,(2E)
- 4-ACETOXYCINNAMALDEHYDE
- 4-acetoxy cinnamaldehyde
- (E)-4-Acetoxycinnamaldehyde
- trans-p-Hydroxylcinnamaldehyde acetate
- bmse010150
- SCHEMBL6964702
- 157096-53-2
- CHEBI:86561
- 4-acetoxy-trans-cinnamaldehyde
- Q27159247
- [4-[(E)-3-oxoprop-1-enyl]phenyl] Acetate
- AKOS005064383
- 4-[(1E)-3-oxoprop-1-en-1-yl]phenyl acetate
- Coumaryl aldehyde acetate
-
- Inchi： 1S/C11H10O3/c1-9(13)14-11-6-4-10(5-7-11)3-2-8-12/h2-8H,1H3/b3-2+
- InChI Key： CDQCYVXBXRQUOL-NSCUHMNNSA-N
- SMILES： O(C(C)=O)C1C=CC(/C=C/C=O)=CC=1
Computed Properties
- Exact Mass: 190.06300
- Monoisotopic Mass: 190.062994177g/mol
- Isotope Atom Count: 0
- Hydrogen Bond Donor Count: 0
- Hydrogen Bond Acceptor Count: 3
- Heavy Atom Count: 14
- Rotatable Bond Count: 4
- Complexity: 225
- Covalently-Bonded Unit Count: 1
- Defined Atom Stereocenter Count: 0
- Undefined Atom Stereocenter Count : 0
- Defined Bond Stereocenter Count: 1
- Undefined Bond Stereocenter Count: 0
- XLogP3: 1.6
- Topological Polar Surface Area: 43.4?2
Experimental Properties
- PSA: 43.37000
- LogP: 1.82400
2-Propenal,3-[4-(acetyloxy)phenyl]-, (2E)- Related Literature
-
Kay S. McMillan,Anthony G. McCluskey,Annette Sorensen,Marie Boyd,Michele Zagnoni Analyst, 2016,141, 100-110
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Alexandre Vimont,Arnaud Travert,Philippe Bazin,Jean-Claude Lavalley,Marco Daturi,Christian Serre,Gérard Férey,Sandrine Bourrelly,Philip L. Llewellyn Chem. Commun., 2007, 3291-3293
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Xing Zhao,Lu Bai,Rui-Ying Bao,Zheng-Ying Liu,Ming-Bo Yang,Wei Yang RSC Adv., 2017,7, 46297-46305
-
Liao Xiaoqing,Li Ruiyi,Li Zaijun,Sun Xiulan,Wang Zhouping,Liu Junkang New J. Chem., 2015,39, 5240-5248
157096-53-2 (2-Propenal,3-[4-(acetyloxy)phenyl]-, (2E)-) Related Products
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