Cas no 1006619-84-6 (2-Amino-5-bromo-3-methylbenzamide)
1006619-84-6 structure
Product Name:2-Amino-5-bromo-3-methylbenzamide
CAS No:1006619-84-6
MF:C8H9BrN2O
MW:229.073860883713
CID:2104981
PubChem ID:58540804
Update Time:2024-03-01
2-Amino-5-bromo-3-methylbenzamide Chemical and Physical Properties
Names and Identifiers
-
- 2-amino-5-bromo-3-methylBenzamide
- QSMADVLNDNZABL-UHFFFAOYSA-N
- Benzamide, 2-amino-5-bromo-3-methyl-
- 2-Amino-5-bromo-3-methylbenzamide
-
- Inchi： 1S/C8H9BrN2O/c1-4-2-5(9)3-6(7(4)10)8(11)12/h2-3H,10H2,1H3,(H2,11,12)
- InChI Key： QSMADVLNDNZABL-UHFFFAOYSA-N
- SMILES： BrC1C=C(C(N)=O)C(=C(C)C=1)N
Computed Properties
- Exact Mass: 227.98983g/mol
- Monoisotopic Mass: 227.98983g/mol
- Isotope Atom Count: 0
- Hydrogen Bond Donor Count: 2
- Hydrogen Bond Acceptor Count: 2
- Heavy Atom Count: 12
- Rotatable Bond Count: 1
- Complexity: 186
- 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: 2.4
- Topological Polar Surface Area: 69.1
2-Amino-5-bromo-3-methylbenzamide Related Literature
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Bidyut Kumar Kundu,Rinky Singh,Ritudhwaj Tiwari,Debasis Nayak New J. Chem., 2019,43, 4867-4877
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Yang Xu,Min Wang,Donghui Wei,Rongqiang Tian,Zheng Duan,Fran?ois Mathey Dalton Trans., 2019,48, 5523-5526
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Jialiang Yuan,Ran Dong,Yuan Li,Yang Liu,Zhuo Zheng,Yuxia Liu,Yan Sun,Benhe Zhong,Zhenguo Wu,Xiaodong Guo Chem. Commun., 2021,57, 13004-13007
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Supaporn Sawadjoon,Joseph S. M. Samec Org. Biomol. Chem., 2011,9, 2548-2554
1006619-84-6 (2-Amino-5-bromo-3-methylbenzamide) Related Products
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