Cas no 921617-37-0 (Methyl 6-(acetyloxy)hexa-2,4-dienoate)
921617-37-0 structure
Product Name:Methyl 6-(acetyloxy)hexa-2,4-dienoate
CAS No:921617-37-0
MF:C9H12O4
MW:184.189183235168
CID:743903
Update Time:2023-08-03
Methyl 6-(acetyloxy)hexa-2,4-dienoate Chemical and Physical Properties
Names and Identifiers
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- 2,4-Hexadienoic acid, 6-(acetyloxy)-, methyl ester, (2Z,4E)-
- methyl 6-acetyloxyhexa-2,4-dienoate
- Methyl 6-(acetyloxy)hexa-2,4-dienoate
-
- Inchi: 1S/C9H12O4/c1-8(10)13-7-5-3-4-6-9(11)12-2/h3-6H,7H2,1-2H3
- InChI Key: VDGPQLGQAQOBHT-UHFFFAOYSA-N
- SMILES: O(C(C)=O)CC=CC=CC(=O)OC
Computed Properties
- Hydrogen Bond Donor Count: 0
- Hydrogen Bond Acceptor Count: 4
- Heavy Atom Count: 13
- Rotatable Bond Count: 6
- Complexity: 228
- Topological Polar Surface Area: 52.6
Methyl 6-(acetyloxy)hexa-2,4-dienoate Related Literature
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Michael Kappl,Paul M. Young,Daniela Traini,Sanyog Jain RSC Adv., 2016,6, 25789-25798
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Adeline Huiling Loo,Alessandra Bonanni,Martin Pumera Analyst, 2013,138, 467-471
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Inês S. Albuquerque,Hélia F. Jeremias,Miguel Chaves-Ferreira,Dijana Matak-Vinkovic,Omar Boutureira,Carlos C. Rom?o Chem. Commun., 2015,51, 3993-3996
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Hamid Heydari,Mohammad B. Gholivand New J. Chem., 2017,41, 237-244
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Philipp Traber,Stephan Kupfer,Stefanie Gr?fe,Isabelle Baussanne,Martine Demeunynck,Jean-Marie Mouesca,Serge Gambarelli,Vincent Artero,Murielle Chavarot-Kerlidou Chem. Sci., 2018,9, 4152-4159
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