Cas no 1155128-15-6 (4-bromo-1-methyl-1H-pyrrole-2-carboxylic acid amide)
1155128-15-6 structure
Product Name:4-bromo-1-methyl-1H-pyrrole-2-carboxylic acid amide
CAS No:1155128-15-6
MF:C6H7BrN2O
MW:203.036580324173
CID:2073644
PubChem ID:43411153
Update Time:2025-04-21
4-bromo-1-methyl-1H-pyrrole-2-carboxylic acid amide Chemical and Physical Properties
Names and Identifiers
-
- 4-bromo-1-methyl-1H-pyrrole-2-carboxylic acid amide
- VRSVVBLXMYZMRD-UHFFFAOYSA-N
- AKOS009087024
- 4-BROMO-1-METHYL-1H-PYRROLE-2-CARBOXAMIDE
- 1155128-15-6
- SCHEMBL13835030
- 4-bromo-1-methylpyrrole-2-carboxamide
-
- Inchi： 1S/C6H7BrN2O/c1-9-3-4(7)2-5(9)6(8)10/h2-3H,1H3,(H2,8,10)
- InChI Key： VRSVVBLXMYZMRD-UHFFFAOYSA-N
- SMILES： BrC1C=C(C(N)=O)N(C)C=1
Computed Properties
- Exact Mass: 201.97418g/mol
- Monoisotopic Mass: 201.97418g/mol
- Isotope Atom Count: 0
- Hydrogen Bond Donor Count: 1
- Hydrogen Bond Acceptor Count: 1
- Heavy Atom Count: 10
- Rotatable Bond Count: 1
- Complexity: 151
- 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: 0.6
- Topological Polar Surface Area: 48?2
4-bromo-1-methyl-1H-pyrrole-2-carboxylic acid amide Related Literature
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Craig A. Kelly,David R. Rosseinsky Phys. Chem. Chem. Phys., 2001,3, 2086-2090
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2. Excimer emission and magnetoluminescence of radical-based zinc(ii) complexes doped in host crystals?Shojiro Kimura,Tetsuro Kusamoto Chem. Commun., 2020,56, 11195-11198
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Amandine Altmayer-Henzien,Valérie Declerck,David J. Aitken,Ewen Lescop,Denis Merlet,Jonathan Farjon Org. Biomol. Chem., 2013,11, 7611-7615
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M. Zeiger,N. J?ckel,P. Strubel,L. Borchardt,R. Reinhold,W. Nickel,J. Eckert,V. Presser,S. Kaskel J. Mater. Chem. A, 2015,3, 17983-17990
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David White,Sean R. Stowell Biomater. Sci., 2017,5, 463-474
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