Cas no 95971-69-0 (4,4'-(1,3-Dioxane-4,5-diyl)bis(2-methoxyphenol))
95971-69-0 structure
Product Name:4,4'-(1,3-Dioxane-4,5-diyl)bis(2-methoxyphenol)
CAS No:95971-69-0
MF:C18H20O6
MW:332.347805976868
CID:734824
PubChem ID:71331203
Update Time:2024-03-01
4,4'-(1,3-Dioxane-4,5-diyl)bis(2-methoxyphenol) Chemical and Physical Properties
Names and Identifiers
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- 4-[4-(4-hydroxy-3-methoxyphenyl)-1,3-dioxan-5-yl]-2-methoxyphenol
- 4,4'-(1,3-Dioxane-4,5-diyl)bis(2-methoxyphenol)
- Phenol, 4,4'-(1,3-dioxane-4,5-diyl)bis[2-methoxy-
- 95971-69-0
- DTXSID60759805
-
- Inchi： 1S/C18H20O6/c1-21-16-7-11(3-5-14(16)19)13-9-23-10-24-18(13)12-4-6-15(20)17(8-12)22-2/h3-8,13,18-20H,9-10H2,1-2H3
- InChI Key： IXHCXCCPMCROLR-UHFFFAOYSA-N
- SMILES： O1COCC(C2C=CC(=C(C=2)OC)O)C1C1C=CC(=C(C=1)OC)O
Computed Properties
- Exact Mass: 332.12598835g/mol
- Monoisotopic Mass: 332.12598835g/mol
- Isotope Atom Count: 0
- Hydrogen Bond Donor Count: 2
- Hydrogen Bond Acceptor Count: 6
- Heavy Atom Count: 24
- Rotatable Bond Count: 4
- Complexity: 392
- Covalently-Bonded Unit Count: 1
- Defined Atom Stereocenter Count: 0
- Undefined Atom Stereocenter Count : 2
- Defined Bond Stereocenter Count: 0
- Undefined Bond Stereocenter Count: 0
- Topological Polar Surface Area: 77.4
- XLogP3: 2.3
4,4'-(1,3-Dioxane-4,5-diyl)bis(2-methoxyphenol) Related Literature
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Dhamodaran Manikandan,S. Amirthapandian,I. S. Zhidkov,A. I. Kukharenko,S. O. Cholakh,Ramaswamy Murugan Phys. Chem. Chem. Phys., 2018,20, 6500-6514
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Jianyao Huang,Dong Gao,Zhihui Chen,Weifeng Zhang Polym. Chem., 2021,12, 2471-2480
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4. An all-solid-state imprinted polymer-based potentiometric sensor for determination of bisphenol S?Rongning Liang,Tanji Yin,Ruiqing Yao,Wei Qin RSC Adv., 2016,6, 73308-73312
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Robert J. Meagher,Anson V. Hatch,Ronald F. Renzi,Anup K. Singh Lab Chip, 2008,8, 2046-2053
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