Cas no 477800-93-4 (5-(1-Propenyl)-1,2,3,4-benzenetetrol; (E)-form, 1,2,4-Tri-Me ether)
477800-93-4 structure
Product Name:5-(1-Propenyl)-1,2,3,4-benzenetetrol; (E)-form, 1,2,4-Tri-Me ether
CAS No:477800-93-4
MF:C12H16O4
MW:224.253044128418
CID:2647217
Update Time:2025-03-26
5-(1-Propenyl)-1,2,3,4-benzenetetrol; (E)-form, 1,2,4-Tri-Me ether Chemical and Physical Properties
Names and Identifiers
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- Phenol, 2,3,6-trimethoxy-5-(1E)-1-propen-1-yl-
- 5-(1-Propenyl)-1,2,3,4-benzenetetrol; (E)-form, 1,2,4-Tri-Me ether
-
- Inchi： 1S/C12H16O4/c1-5-6-8-7-9(14-2)12(16-4)10(13)11(8)15-3/h5-7,13H,1-4H3/b6-5+
- InChI Key： LNULYVLKYVWZFB-AATRIKPKSA-N
- SMILES： COC1C(OC)=C(O)C(OC)=C(/C=C/C)C=1
Computed Properties
- Hydrogen Bond Donor Count: 1
- Hydrogen Bond Acceptor Count: 4
- Heavy Atom Count: 16
- XLogP3: 2.355
Experimental Properties
- Density: 1.116±0.06 g/cm3(Predicted)
- Boiling Point: 373.8±42.0 °C(Predicted)
- pka: 9.52±0.20(Predicted)
5-(1-Propenyl)-1,2,3,4-benzenetetrol; (E)-form, 1,2,4-Tri-Me ether Related Literature
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Zhiyan Chen,Nan Wu,Yaobing Wang,Bing Wang,Yingde Wang J. Mater. Chem. A, 2018,6, 516-526
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Yong Ping Huang,Tao Tao,Zheng Chen,Wei Han,Ying Wu,Chunjiang Kuang,Shaoxiong Zhou,Ying Chen J. Mater. Chem. A, 2014,2, 18831-18837
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Shun-Ze Zhan,Mian Li,Xiao-Ping Zhou,Dan Li,Seik Weng Ng RSC Adv., 2011,1, 1457-1459
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Xiaoming Liu,Zachary D. Hood,Wangda Li,Donovan N. Leonard,Arumugam Manthiram,Miaofang Chi J. Mater. Chem. A, 2021,9, 2111-2119
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Yaling Zhang,Chunhui Dai,Shiwei Zhou,Bin Liu Chem. Commun., 2018,54, 10092-10095
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