Cas no 50372-58-2 (Methanone, (4,5-dibromo-1H-pyrrol-2-yl)(2,5-dihydroxyphenyl)-)
50372-58-2 structure
Product Name:Methanone, (4,5-dibromo-1H-pyrrol-2-yl)(2,5-dihydroxyphenyl)-
CAS No:50372-58-2
MF:C11H7Br2NO3
MW:360.986181497574
CID:365047
PubChem ID:21488745
Update Time:2025-04-19
Methanone, (4,5-dibromo-1H-pyrrol-2-yl)(2,5-dihydroxyphenyl)- Chemical and Physical Properties
Names and Identifiers
-
- Methanone, (4,5-dibromo-1H-pyrrol-2-yl)(2,5-dihydroxyphenyl)-
- (4,5-dibromo-1H-pyrrol-2-yl)-(2,5-dihydroxyphenyl)methanone
- SCHEMBL11864815
- 50372-58-2
- (4,5-Dibromo-1H-pyrrol-2-yl)(2,5-dihydroxyphenyl)methanone
- DTXSID60614703
-
- Inchi： 1S/C11H7Br2NO3/c12-7-4-8(14-11(7)13)10(17)6-3-5(15)1-2-9(6)16/h1-4,14-16H
- InChI Key： YKCQKCYNUIQPRK-UHFFFAOYSA-N
- SMILES： BrC1=C(C=C(C(C2C=C(C=CC=2O)O)=O)N1)Br
Computed Properties
- Exact Mass: 358.87921
- Monoisotopic Mass: 358.87927g/mol
- Isotope Atom Count: 0
- Hydrogen Bond Donor Count: 3
- Hydrogen Bond Acceptor Count: 3
- Heavy Atom Count: 17
- Rotatable Bond Count: 2
- Complexity: 302
- 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: 3.9
- Topological Polar Surface Area: 73.3?2
Experimental Properties
- PSA: 73.32
Methanone, (4,5-dibromo-1H-pyrrol-2-yl)(2,5-dihydroxyphenyl)- Related Literature
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Joseph H. Bisesi,Tara Sabo-Attwood Environ. Sci.: Nano, 2014,1, 574-583
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Manickam Bakthadoss,Tadiparthi Thirupathi Reddy,Vishal Agarwal,Duddu S. Sharada Chem. Commun., 2022,58, 1406-1409
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J. Zagora,M. Vosla?,L. Schreiberová,I. Schreiber Phys. Chem. Chem. Phys., 2002,4, 1284-1291
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Ziyang Deng,Changwei Chen,Sunliang Cui RSC Adv., 2016,6, 93753-93755
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Jason Wan Lab Chip, 2020,20, 4528-4538
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