Cas no 886036-39-1 (1H-Pyrrol-2-amine,N,N-dimethyl-3-nitro-)
886036-39-1 structure
Product Name:1H-Pyrrol-2-amine,N,N-dimethyl-3-nitro-
CAS No:886036-39-1
MF:C6H9N3O2
MW:155.154560804367
CID:712040
PubChem ID:45121913
Update Time:2025-04-19
1H-Pyrrol-2-amine,N,N-dimethyl-3-nitro- Chemical and Physical Properties
Names and Identifiers
-
- 1H-Pyrrol-2-amine,N,N-dimethyl-3-nitro-
- dimethyl(3-nitropyrrol-2-yl)amine
- ZRYXNYQXICLIHG-UHFFFAOYSA-N
- SCHEMBL1776177
- N,N-Dimethyl-3-nitro-1H-pyrrol-2-amine
- 886036-39-1
-
- Inchi： 1S/C6H9N3O2/c1-8(2)6-5(9(10)11)3-4-7-6/h3-4,7H,1-2H3
- InChI Key： ZRYXNYQXICLIHG-UHFFFAOYSA-N
- SMILES： [O-][N+](C1C=CNC=1N(C)C)=O
Computed Properties
- Exact Mass: 155.069
- Monoisotopic Mass: 155.069
- Isotope Atom Count: 0
- Hydrogen Bond Donor Count: 1
- Hydrogen Bond Acceptor Count: 3
- Heavy Atom Count: 11
- Rotatable Bond Count: 1
- Complexity: 154
- 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: 64.8A^2
- XLogP3: 1
1H-Pyrrol-2-amine,N,N-dimethyl-3-nitro- Related Literature
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Amit Kumar Majhi,Subbarao Kanchi,V. Venkataraman,K. G. Ayappa,Prabal K. Maiti Soft Matter, 2015,11, 8632-8640
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Xinhuan Wang,Shuangfei Cai,Cui Qi Analyst, 2017,142, 2500-2506
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J. Zagora,M. Vosla?,L. Schreiberová,I. Schreiber Phys. Chem. Chem. Phys., 2002,4, 1284-1291
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Shaun D. Wong,Edward I. Solomon Dalton Trans., 2014,43, 17567-17577
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Huading Zhang,Lee R. Moore,Maciej Zborowski,P. Stephen Williams,Shlomo Margel,Jeffrey J. Chalmers Analyst, 2005,130, 514-527
886036-39-1 (1H-Pyrrol-2-amine,N,N-dimethyl-3-nitro-) Related Products
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