Cas no 106050-89-9 (3-(4-methyl-1-piperazinyl)-5-nitro-Benzenamine)
106050-89-9 structure
Product Name:3-(4-methyl-1-piperazinyl)-5-nitro-Benzenamine
CAS No:106050-89-9
MF:C11H16N4O2
MW:236.270341873169
CID:1097736
PubChem ID:13616653
Update Time:2025-04-20
3-(4-methyl-1-piperazinyl)-5-nitro-Benzenamine Chemical and Physical Properties
Names and Identifiers
-
- 3-(4-methyl-1-piperazinyl)-5-nitro-Benzenamine
- 3-(4-methylpiperazin-1-yl)-5-nitrobenzenamine
- AKOS019335257
- DB-330768
- SCHEMBL15961228
- 106050-89-9
-
- Inchi： 1S/C11H16N4O2/c1-13-2-4-14(5-3-13)10-6-9(12)7-11(8-10)15(16)17/h6-8H,2-5,12H2,1H3
- InChI Key： MHXJHCLHERUEPT-UHFFFAOYSA-N
- SMILES： [O-][N+](C1=CC(=CC(=C1)N1CCN(C)CC1)N)=O
Computed Properties
- Exact Mass: 236.12748
- Monoisotopic Mass: 236.12732577g/mol
- Isotope Atom Count: 0
- Hydrogen Bond Donor Count: 1
- Hydrogen Bond Acceptor Count: 5
- Heavy Atom Count: 17
- Rotatable Bond Count: 1
- Complexity: 273
- 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: 1
- Topological Polar Surface Area: 78.3?2
Experimental Properties
- PSA: 75.64
3-(4-methyl-1-piperazinyl)-5-nitro-Benzenamine Related Literature
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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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Kaiyuan Huang,Wangkang Qiu,Meilian Ou,Xiaorui Liu,Zenan Liao,Sheng Chu RSC Adv., 2020,10, 18824-18829
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L. Di Michele,D. Fiocco,F. Varrato,E. Eiser,G. Foffi Soft Matter, 2014,10, 3633-3648
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Supaporn Sawadjoon,Joseph S. M. Samec Org. Biomol. Chem., 2011,9, 2548-2554
106050-89-9 (3-(4-methyl-1-piperazinyl)-5-nitro-Benzenamine) Related Products
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