Cas no 63389-50-4 (Acetamide, 2,2-dibromo-N-(4-methylphenyl)-)
63389-50-4 structure
Product Name:Acetamide, 2,2-dibromo-N-(4-methylphenyl)-
CAS No:63389-50-4
MF:C9H9Br2NO
MW:306.981860876083
CID:390170
PubChem ID:71372785
Update Time:2025-04-19
Acetamide, 2,2-dibromo-N-(4-methylphenyl)- Chemical and Physical Properties
Names and Identifiers
-
- Acetamide, 2,2-dibromo-N-(4-methylphenyl)-
- 2,2-dibromo-N-(4-methylphenyl)acetamide
- 63389-50-4
- DTXSID10795637
-
- Inchi： 1S/C9H9Br2NO/c1-6-2-4-7(5-3-6)12-9(13)8(10)11/h2-5,8H,1H3,(H,12,13)
- InChI Key： FHTLOUVVHLKBRC-UHFFFAOYSA-N
- SMILES： BrC(C(NC1C=CC(C)=CC=1)=O)Br
Computed Properties
- Exact Mass: 306.90304g/mol
- Monoisotopic Mass: 304.90509g/mol
- Isotope Atom Count: 0
- Hydrogen Bond Donor Count: 1
- Hydrogen Bond Acceptor Count: 1
- Heavy Atom Count: 13
- Rotatable Bond Count: 2
- Complexity: 177
- 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: 3.4
- Topological Polar Surface Area: 29.1?2
Acetamide, 2,2-dibromo-N-(4-methylphenyl)- Related Literature
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Kanjun Sun,Fengting Hua,Shuzhen Cui,Yanrong Zhu,Hui Peng,Guofu Ma RSC Adv., 2021,11, 37631-37642
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Kaiyuan Huang,Wangkang Qiu,Meilian Ou,Xiaorui Liu,Zenan Liao,Sheng Chu RSC Adv., 2020,10, 18824-18829
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Eunice Y.-L. Hui,Bhimsen Rout,Yaw Sing Tan,Kok-Ping Chan,Charles W. Johannes Org. Biomol. Chem., 2018,16, 389-392
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4. An autonomous self-optimizing flow machine for the synthesis of pyridine–oxazoline (PyOX) ligands?Eric Wimmer,Daniel Cortés-Borda,Solène Brochard,Elvina Barré,Charlotte Truchet,Fran?ois-Xavier Felpin React. Chem. Eng., 2019,4, 1608-1615
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Philipp Traber,Stephan Kupfer,Stefanie Gr?fe,Isabelle Baussanne,Martine Demeunynck,Jean-Marie Mouesca,Serge Gambarelli,Vincent Artero,Murielle Chavarot-Kerlidou Chem. Sci., 2018,9, 4152-4159
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