Cas no 85985-71-3 (Cyclopenta[c]furo[3',2':4,5]furo[2,3-h][1]benzopyran-8-sulfonicacid, 1,2,3,6a,8,9,9a,11-octahydro-4-methoxy-1,11-dioxo-, sodium salt (1:1))
![Cyclopenta[c]furo[3',2':4,5]furo[2,3-h][1]benzopyran-8-sulfonicacid, 1,2,3,6a,8,9,9a,11-octahydro-4-methoxy-1,11-dioxo-, sodium salt (1:1) structure](https://ossimg.kuujia.com/scimg/86000/85985-71-3x500.png)
85985-71-3 structure
Product Name:Cyclopenta[c]furo[3',2':4,5]furo[2,3-h][1]benzopyran-8-sulfonicacid, 1,2,3,6a,8,9,9a,11-octahydro-4-methoxy-1,11-dioxo-, sodium salt (1:1)
CAS No:85985-71-3
MF:C17H13NaO9S
MW:416.334495306015
CID:732411
PubChem ID:23674753
Update Time:2025-04-19
Cyclopenta[c]furo[3',2':4,5]furo[2,3-h][1]benzopyran-8-sulfonicacid, 1,2,3,6a,8,9,9a,11-octahydro-4-methoxy-1,11-dioxo-, sodium salt (1:1) Chemical and Physical Properties
Names and Identifiers
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- Cyclopenta[c]furo[3',2':4,5]furo[2,3-h][1]benzopyran-8-sulfonicacid, 1,2,3,6a,8,9,9a,11-octahydro-4-methoxy-1,11-dioxo-, sodium salt (1:1)
- Cyclopenta[c]furo[3',2':4,5]furo[2,3-h][1]benzopyran-8-sulfonicacid, 1,2,3,6a,8,9,9a,11-octahydro-4-methoxy-1,11-dioxo-, sodi
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- Inchi： 1S/C17H14O9S.Na/c1-23-9-5-10-14(7-4-11(27(20,21)22)25-17(7)24-10)15-13(9)6-2-3-8(18)12(6)16(19)26-15;/h5,7,11,17H,2-4H2,1H3,(H,20,21,22);/q;+1/p-1
- InChI Key： UPNSVRRUHWJFQU-UHFFFAOYSA-M
- SMILES： S(C1CC2C3C4=C(C(=CC=3OC2O1)OC)C1=C(C(=O)O4)C(CC1)=O)(=O)(=O)[O-].[Na+]
Computed Properties
- Exact Mass: 416.017797
- Monoisotopic Mass: 416.017797
- Isotope Atom Count: 0
- Hydrogen Bond Donor Count: 0
- Hydrogen Bond Acceptor Count: 9
- Heavy Atom Count: 28
- Rotatable Bond Count: 2
- Complexity: 847
- Covalently-Bonded Unit Count: 2
- Defined Atom Stereocenter Count: 0
- Undefined Atom Stereocenter Count : 3
- Defined Bond Stereocenter Count: 0
- Undefined Bond Stereocenter Count: 0
- Topological Polar Surface Area: 137
Experimental Properties
- Boiling Point: °Cat760mmHg
- Flash Point: °C
Cyclopenta[c]furo[3',2':4,5]furo[2,3-h][1]benzopyran-8-sulfonicacid, 1,2,3,6a,8,9,9a,11-octahydro-4-methoxy-1,11-dioxo-, sodium salt (1:1) Related Literature
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James D. Kirkham,Patrick M. Delaney,George J. Ellames,Eleanor C. Row,Joseph P. A. Harrity Chem. Commun., 2010,46, 5154-5156
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José M. Rivera,Mariana Martín-Hidalgo,Jean C. Rivera-Ríos Org. Biomol. Chem., 2012,10, 7562-7565
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M. Sheykhan,S. Khani,S. Shaabanzadeh,M. Joafshan Green Chem., 2017,19, 5940-5948
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Muniyandi Sankaralingam,So Hyun Jeon,Yong-Min Lee,Mi Sook Seo,Wonwoo Nam Dalton Trans., 2016,45, 376-383
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Benjamin Gabriel Poulson,Kacper Szczepski,Joanna Izabela Lachowicz,Lukasz Jaremko,Abdul-Hamid Emwas,Mariusz Jaremko RSC Adv., 2020,10, 215-227
85985-71-3 (Cyclopenta[c]furo[3',2':4,5]furo[2,3-h][1]benzopyran-8-sulfonicacid, 1,2,3,6a,8,9,9a,11-octahydro-4-methoxy-1,11-dioxo-, sodium salt (1:1)) Related Products
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