Cas no 820243-52-5 (Methanone, (2,4-dibromo-6-hydroxyphenyl)(2-hydroxyphenyl)-)
820243-52-5 structure
Product Name:Methanone, (2,4-dibromo-6-hydroxyphenyl)(2-hydroxyphenyl)-
CAS No:820243-52-5
MF:C13H8Br2O3
MW:372.008822441101
CID:700264
PubChem ID:11222506
Update Time:2025-04-19
Methanone, (2,4-dibromo-6-hydroxyphenyl)(2-hydroxyphenyl)- Chemical and Physical Properties
Names and Identifiers
-
- Methanone, (2,4-dibromo-6-hydroxyphenyl)(2-hydroxyphenyl)-
- (2,4-dibromo-6-hydroxyphenyl)-(2-hydroxyphenyl)methanone
- DTXSID20459273
- 820243-52-5
-
- Inchi： 1S/C13H8Br2O3/c14-7-5-9(15)12(11(17)6-7)13(18)8-3-1-2-4-10(8)16/h1-6,16-17H
- InChI Key： CGWJGQFOGCGYAJ-UHFFFAOYSA-N
- SMILES： BrC1=CC(=CC(=C1C(C1C=CC=CC=1O)=O)O)Br
Computed Properties
- Exact Mass: 371.88197g/mol
- Monoisotopic Mass: 369.88402g/mol
- Isotope Atom Count: 0
- Hydrogen Bond Donor Count: 2
- Hydrogen Bond Acceptor Count: 3
- Heavy Atom Count: 18
- Rotatable Bond Count: 2
- Complexity: 311
- 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: 4.5
- Topological Polar Surface Area: 57.5?2
Methanone, (2,4-dibromo-6-hydroxyphenyl)(2-hydroxyphenyl)- Related Literature
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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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Thi Thu Tram Nguyen,Thanh Binh Nguyen Org. Biomol. Chem., 2021,19, 6015-6020
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J. Zagora,M. Vosla?,L. Schreiberová,I. Schreiber Phys. Chem. Chem. Phys., 2002,4, 1284-1291
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