Safety of Methyl 3-phenyl-2-propenoate. In 2019.0 PHYS CHEM CHEM PHYS published article about PHOTOACTIVE YELLOW PROTEIN; CLUSTER-EXPANSION; EXCITED-STATES; WAVE-FUNCTION; ECTOTHIORHODOSPIRA-HALOPHILA; HYDRATED COMPLEX; METHYL CINNAMATE; SINAPIC ACID; DYNAMICS; SAC in [Kinoshita, Shin-nosuke; Inokuchi, Yoshiya; Onitsuka, Yuuki; Kohguchi, Hiroshi; Ebata, Takayuki] Hiroshima Univ, Grad Sch Sci, Dept Chem, Higashihiroshima 7398526, Japan; [Akai, Nobuyuki] Tokyo Univ Agr & Technol, Grad Sch Bioapplicat & Syst Engn BASE, Naka Cho, Koganei, Tokyo 1848588, Japan; [Shiraogawa, Takafumi; Ehara, Masahiro] SOKENDAI, Grad Univ Adv Studies, Okazaki, Aichi 4448585, Japan; [Ehara, Masahiro] Inst Mol Sci & Res Ctr Computat Sci, 38 Myodayi, Okazaki, Aichi 4448585, Japan; [Yamazaki, Kaoru] Tohoku Univ, Inst Mat Res, Aoba Ku, Katahira 2-1-1, Sendai, Miyagi 9808577, Japan; [Harabuchi, Yu; Maeda, Satoshi] Hokkaido Univ, Fac Sci, Dept Chem, Sapporo, Hokkaido 0600810, Japan; [Harabuchi, Yu] JST, PRESTO, 4-1-8 Honcho, Kawaguchi, Saitama 3320012, Japan; [Harabuchi, Yu; Maeda, Satoshi] Hokkaido Univ, Inst Chem React Design & Discovery WPI ICReDD, Sapporo, Hokkaido 0010021, Japan in 2019.0, Cited 56.0. The Name is Methyl 3-phenyl-2-propenoate. Through research, I have a further understanding and discovery of 103-26-4.
The electronic states and photochemistry including nonradiative decay (NRD) and trans(E) -> cis(Z) isomerization of methylcinnamate (MC) and its hydrogen-bonded complex with methanol have been investigated under jet-cooled conditions. S-1((1)n pi*) and S-2((1)pi pi*) are directly observed in MC. This is the first direct observation of S-1(1n pi*) in cinnamate derivatives. Surprisingly, the order of the energies between the n pi* and pi pi* states is opposite to substituted cinnamates. TD-DFT and SAC-CI calculations support the observed result and show that the substitution to the benzene ring largely lowers the (1)pi pi* energy while the effect on (1)n pi* is rather small. The S-2(pi pi*) state lifetime of MC is determined to be equal to or shorter than 10 ps, and the production of the transient T-1 state is observed. The T-1(pi pi*) state is calculated to have a structure in which propenyl C=C is twisted by 90 degrees, suggesting the trans -> cis isomerization proceeds via T-1. The production of the cis isomer is confirmed by low-temperature matrix-isolated FTIR spectroscopy. The effect of H-bonding is examined for the MC-methanol complex. The S-2 lifetime of MC-methanol is determined to be 180 ps, indicating that the H-bonding to the C=O group largely prohibits the (1)pi pi* -> (1)n pi* internal conversion. This lifetime elongation in the methanol complex also describes well a higher fluorescence quantum yield of MC in methanol solution than in cyclohexane, while such a solvent dependence is not observed in para-substituted MC. Determination of the photochemical reaction pathways of MC and MC-methanol will help us to design photofunctional cinnamate derivatives.
Safety of Methyl 3-phenyl-2-propenoate. Bye, fridends, I hope you can learn more about C10H10O2, If you have any questions, you can browse other blog as well. See you lster.
Reference:
Article; Weng, Shiue-Shien; Ke, Chih-Shueh; Chen, Fong-Kuang; Lyu, You-Fu; Lin, Guan-Ying; Tetrahedron; vol. 67; 9; (2011); p. 1640 – 1648;,
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