Cas no 94166-56-0 (2-Pyridinamine,6-methoxy-3-nitro-N-propyl-)
94166-56-0 structure
Product Name:2-Pyridinamine,6-methoxy-3-nitro-N-propyl-
CAS No:94166-56-0
MF:C9H13N3O3
MW:211.217821836472
CID:818793
PubChem ID:3023912
Update Time:2025-04-19
2-Pyridinamine,6-methoxy-3-nitro-N-propyl- Chemical and Physical Properties
Names and Identifiers
-
- 2-Pyridinamine,6-methoxy-3-nitro-N-propyl-
- 6-methoxy-3-nitro-N-propylpyridin-2-amine
- SCHEMBL10654754
- NS00040207
- MVGVWQWWDOENQW-UHFFFAOYSA-N
- 6-methoxy-3-nitro-2-n-propylaminopyridine
- 94166-56-0
- DTXSID70240911
- EINECS 303-352-6
-
- Inchi： 1S/C9H13N3O3/c1-3-6-10-9-7(12(13)14)4-5-8(11-9)15-2/h4-5H,3,6H2,1-2H3,(H,10,11)
- InChI Key： MVGVWQWWDOENQW-UHFFFAOYSA-N
- SMILES： O(C)C1=CC=C(C(=N1)NCCC)[N+](=O)[O-]
Computed Properties
- Exact Mass: 211.09569129g/mol
- Monoisotopic Mass: 211.09569129g/mol
- Isotope Atom Count: 0
- Hydrogen Bond Donor Count: 1
- Hydrogen Bond Acceptor Count: 5
- Heavy Atom Count: 15
- Rotatable Bond Count: 4
- Complexity: 207
- 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
- Surface Charge: 0
- Tautomer Count: 2
- XLogP3: 2.7
- Topological Polar Surface Area: 80?2
2-Pyridinamine,6-methoxy-3-nitro-N-propyl- Related Literature
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Qiyuan Wu,Shangmin Xiong,Peichuan Shen,Shen Zhao,Alexander Orlov Catal. Sci. Technol., 2015,5, 2059-2064
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Xing Zhao,Lu Bai,Rui-Ying Bao,Zheng-Ying Liu,Ming-Bo Yang,Wei Yang RSC Adv., 2017,7, 46297-46305
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Partha Laskar,Christine Dufès Nanoscale Adv., 2021,3, 6007-6026
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Huading Zhang,Lee R. Moore,Maciej Zborowski,P. Stephen Williams,Shlomo Margel,Jeffrey J. Chalmers Analyst, 2005,130, 514-527
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Alexandre Vimont,Arnaud Travert,Philippe Bazin,Jean-Claude Lavalley,Marco Daturi,Christian Serre,Gérard Férey,Sandrine Bourrelly,Philip L. Llewellyn Chem. Commun., 2007, 3291-3293
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