Cas no 143851-49-4 (3-Hexenoic acid, 3-methyl-, (E)-)
143851-49-4 structure
Product Name:3-Hexenoic acid, 3-methyl-, (E)-
CAS No:143851-49-4
MF:C7H12O2
MW:128.168982505798
CID:1313906
Update Time:2024-08-18
3-Hexenoic acid, 3-methyl-, (E)- Chemical and Physical Properties
Names and Identifiers
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- 3-Hexenoic acid, 3-methyl-, (E)-
- 3-Hexenoic acid, 3-methyl-, (3E)-
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- Inchi： 1S/C7H12O2/c1-3-4-6(2)5-7(8)9/h4H,3,5H2,1-2H3,(H,8,9)/b6-4+
- InChI Key： GBBXAKWLJDVDQY-GQCTYLIASA-N
- SMILES： C(O)(=O)C/C(/C)=C/CC
Computed Properties
- Exact Mass: 128.08376
Experimental Properties
- Density: 0.970±0.06 g/cm3(Predicted)
- Boiling Point: 225.1±9.0 °C(Predicted)
- PSA: 37.3
- pka: 4.62±0.10(Predicted)
3-Hexenoic acid, 3-methyl-, (E)- Related Literature
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Shintaro Takata,Yoshihiro Miura Phys. Chem. Chem. Phys., 2014,16, 24784-24789
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Byungho Lim,Jaewon Jin,Jin Yoo,Seung Yong Han,Kyeongyeol Kim,Sungah Kang,Nojin Park,Sang Moon Lee,Hae Jin Kim,Seung Uk Son Chem. Commun., 2014,50, 7723-7726
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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
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Gang Pan,Yi-jie Bao,Jie Xu,Tao Liu,Cheng Liu,Yan-yan Qiu,Xiao-jing Shi,Hui Yu,Ting-ting Jia,Xia Yuan,Ze-ting Yuan,Yi-jun Cao RSC Adv., 2016,6, 42109-42119
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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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