Cas no 61445-49-6 (Methanone, bis(3,4-dihydroxyphenyl)-)
61445-49-6 structure
Product Name:Methanone, bis(3,4-dihydroxyphenyl)-
CAS No:61445-49-6
MF:C13H10O5
MW:246.215504169464
CID:479130
PubChem ID:458191
Update Time:2025-04-19
Methanone, bis(3,4-dihydroxyphenyl)- Chemical and Physical Properties
Names and Identifiers
-
- Methanone, bis(3,4-dihydroxyphenyl)-
- bis(3,4-dihydroxyphenyl)methanone
- CHEMBL1269420
- BDBM50329694
- SCHEMBL1758192
- 3,3',4,4'-Tetrahydroxybenzophenone
- XZXMWAHILBWKBI-UHFFFAOYSA-N
- DTXSID50332484
- 61445-49-6
-
- Inchi： 1S/C13H10O5/c14-9-3-1-7(5-11(9)16)13(18)8-2-4-10(15)12(17)6-8/h1-6,14-17H
- InChI Key： XZXMWAHILBWKBI-UHFFFAOYSA-N
- SMILES： O=C(C1C=CC(=C(C=1)O)O)C1C=CC(=C(C=1)O)O
Computed Properties
- Exact Mass: 246.0528
- Monoisotopic Mass: 246.05282342g/mol
- Isotope Atom Count: 0
- Hydrogen Bond Donor Count: 4
- Hydrogen Bond Acceptor Count: 5
- Heavy Atom Count: 18
- Rotatable Bond Count: 2
- Complexity: 278
- Covalently-Bonded Unit Count: 1
- Defined Atom Stereocenter Count: 0
- Undefined Atom Stereocenter Count : 0
- Defined Bond Stereocenter Count: 0
- Undefined Bond Stereocenter Count: 0
- XLogP3: 1.8
- Topological Polar Surface Area: 98?2
Experimental Properties
- PSA: 97.99
Methanone, bis(3,4-dihydroxyphenyl)- Related Literature
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Andreas Nenning,Manuel Holzmann,Jürgen Fleig,Alexander K. Opitz Mater. Adv., 2021,2, 5422-5431
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Qiao Song,Angela Bamesberger,Lingyun Yang,Haley Houtwed,Haishi Cao Analyst, 2014,139, 3588-3592
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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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Joo Chuan Yeo,Kenry Lab Chip, 2016,16, 4082-4090
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Shaun D. Wong,Edward I. Solomon Dalton Trans., 2014,43, 17567-17577
61445-49-6 (Methanone, bis(3,4-dihydroxyphenyl)-) Related Products
- 121-71-1(3'-Hydroxyacetophenone)
- 10425-11-3(3,4-Dihydroxybenzophenone)
- 1197-09-7(3',4'-Dihydroxyacetophenone)
- 13020-57-0(3-Hydroxybenzophenone)
- 1137-42-4(4-Hydroxybenzophenone)
- 611-99-4(Bis(4-hydroxy)benzophenone)
- 2098070-20-1(2-(3-(Pyridin-3-yl)-1H-pyrazol-1-yl)acetimidamide)
- 2680771-01-9(4-cyclopentyl-3-{(prop-2-en-1-yloxy)carbonylamino}butanoic acid)
- 1444113-98-7(N-(3-cyanothiolan-3-yl)-2-[(2,2,2-trifluoroethyl)sulfanyl]pyridine-4-carboxamide)
- 332062-08-5(Fmoc-S-3-amino-4,4-diphenyl-butyric acid)
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