Cas no 57248-24-5 (Methanone, (4-chlorophenyl)(2,5-dibromo-3-thienyl)-)
57248-24-5 structure
Product Name:Methanone, (4-chlorophenyl)(2,5-dibromo-3-thienyl)-
CAS No:57248-24-5
MF:C11H5Br2ClOS
MW:380.482799291611
CID:346013
PubChem ID:43344984
Update Time:2025-04-19
Methanone, (4-chlorophenyl)(2,5-dibromo-3-thienyl)- Chemical and Physical Properties
Names and Identifiers
-
- Methanone, (4-chlorophenyl)(2,5-dibromo-3-thienyl)-
- (4-chlorophenyl)-(2,5-dibromothiophen-3-yl)methanone
- DTXSID40655891
- 57248-24-5
- SCHEMBL11849123
- (4-Chlorophenyl)(2,5-dibromothiophen-3-yl)methanone
-
- Inchi： 1S/C11H5Br2ClOS/c12-9-5-8(11(13)16-9)10(15)6-1-3-7(14)4-2-6/h1-5H
- InChI Key： IIZFGKAWQDLYEP-UHFFFAOYSA-N
- SMILES： BrC1=C(C=C(S1)Br)C(C1C=CC(=CC=1)Cl)=O
Computed Properties
- Exact Mass: 377.81165
- Monoisotopic Mass: 377.812
- Isotope Atom Count: 0
- Hydrogen Bond Donor Count: 0
- Hydrogen Bond Acceptor Count: 2
- Heavy Atom Count: 16
- Rotatable Bond Count: 2
- Complexity: 269
- 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
- Topological Polar Surface Area: 45.3A^2
- XLogP3: 5.6
Experimental Properties
- PSA: 17.07
Methanone, (4-chlorophenyl)(2,5-dibromo-3-thienyl)- Related Literature
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Huiying Xu,Lu Zheng,Yu Zhou,Bang-Ce Ye Analyst, 2021,146, 5542-5549
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Jingquan Liu,Huiyun Liu,Zhongfan Jia,Volga Bulmus,Thomas P. Davis Chem. Commun., 2008, 6582-6584
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Huabin Zhang,Shaowu Du CrystEngComm, 2014,16, 4059-4068
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Chandran Rajendran,Govindaswamy Satishkumar,Charlotte Lang,Eric M. Gaigneaux Catal. Sci. Technol., 2020,10, 2583-2592
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Hyejin Moon,Aaron R. Wheeler,Robin L. Garrell,Chang-Jin “CJ” Kim Lab Chip, 2006,6, 1213-1219
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