Cas no 50556-03-1 (2-Propenoic acid, 3-(3-methylphenyl)-, ethyl ester)
50556-03-1 structure
Product Name:2-Propenoic acid, 3-(3-methylphenyl)-, ethyl ester
CAS No:50556-03-1
MF:C12H14O2
MW:190.238363742828
CID:364661
PubChem ID:5372799
Update Time:2025-04-19
2-Propenoic acid, 3-(3-methylphenyl)-, ethyl ester Chemical and Physical Properties
Names and Identifiers
-
- 2-Propenoic acid, 3-(3-methylphenyl)-, ethyl ester
- ethyl 3-(3-methylphenyl)prop-2-enoate
- MFCD00970876
- ETHYL (2E)-3-(3-METHYLPHENYL)PROP-2-ENOATE
- QQRJPDCUZPIHFK-BQYQJAHWSA-N
- SCHEMBL1269501
- EN300-1453820
- (E)-3-m-Tolyl-acrylic acid ethyl ester, 95%
- Ethyl (2E)-3-(3-methylphenyl)-2-propenoate #
- ethyl (E)-3-(3-methylphenyl)prop-2-enoate
- 2-Propenoic acid, 3-(3-methylphenyl)-, ethyl ester, (2E)-
- 50556-03-1
- (E)-3-m-Tolyl-acrylic acid ethyl ester
- 62174-97-4
-
- Inchi： 1S/C12H14O2/c1-3-14-12(13)8-7-11-6-4-5-10(2)9-11/h4-9H,3H2,1-2H3/b8-7+
- InChI Key： QQRJPDCUZPIHFK-BQYQJAHWSA-N
- SMILES： O(C(/C=C/C1C=CC=C(C)C=1)=O)CC
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: 4
- Complexity: 208
- 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: 3.4
- Topological Polar Surface Area: 26.3?2
Experimental Properties
- PSA: 26.3
2-Propenoic acid, 3-(3-methylphenyl)-, ethyl ester Related Literature
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Eric Besson,Stéphane Gastaldi,Emily Bloch,Selma Aslan,Hakim Karoui,Olivier Ouari,Micael Hardy Analyst, 2019,144, 4194-4203
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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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Hanie Hashtroudi,Ian D. R. Mackinnon J. Mater. Chem. C, 2020,8, 13108-13126
-
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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Tao Wang,Yangyang Liu,Yue Deng,Hongbo Fu,Jianmin Chen Environ. Sci.: Nano, 2018,5, 1821-1833
50556-03-1 (2-Propenoic acid, 3-(3-methylphenyl)-, ethyl ester) Related Products
- 7778-83-8(Propyl cinnamate)
- 1754-62-7(methyl-3-phenylprop-2-enoate)
- 20754-20-5(methyl (2E)-3-(4-methylphenyl)prop-2-enoate)
- 103-26-4(Methyl cinnamate)
- 103-36-6(Ethyl cinnamate)
- 7780-06-5(Isopropyl cinnamate)
- 122-67-8(2-Propenoic acid, 3-phenyl-, 2-methylpropyl ester)
- 122-69-0(2-Propenoic acid, 3-phenyl-, 3-phenyl-2-propenyl ester)
- 103-54-8(Cinnamyl acetate)
- 1866-31-5(Allyl cinnamate)
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