Cas no 319474-52-7 (3-(4-methyl-1-piperazinyl)-1,2-Benzenediamine)
319474-52-7 structure
Product Name:3-(4-methyl-1-piperazinyl)-1,2-Benzenediamine
CAS No:319474-52-7
MF:C11H18N4
MW:206.287421703339
CID:1110792
PubChem ID:21877341
Update Time:2025-04-20
3-(4-methyl-1-piperazinyl)-1,2-Benzenediamine Chemical and Physical Properties
Names and Identifiers
-
- 3-(4-methyl-1-piperazinyl)-1,2-Benzenediamine
- 3-(4-Methylpiperazin-1-yl)benzene-1,2-diamine
- SCHEMBL1509507
- 3-(4-Methyl-piperazin-1-yl)-benzene-1,2-diamine
- DA-25144
- 319474-52-7
- BSHKOIWZXZNENI-UHFFFAOYSA-N
-
- Inchi： 1S/C11H18N4/c1-14-5-7-15(8-6-14)10-4-2-3-9(12)11(10)13/h2-4H,5-8,12-13H2,1H3
- InChI Key： BSHKOIWZXZNENI-UHFFFAOYSA-N
- SMILES： N1(C2C=CC=C(C=2N)N)CCN(C)CC1
Computed Properties
- Exact Mass: 206.15334
- Monoisotopic Mass: 206.153146591g/mol
- Isotope Atom Count: 0
- Hydrogen Bond Donor Count: 2
- Hydrogen Bond Acceptor Count: 4
- Heavy Atom Count: 15
- Rotatable Bond Count: 1
- Complexity: 201
- 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: 0.5
- Topological Polar Surface Area: 58.5?2
Experimental Properties
- PSA: 58.52
3-(4-methyl-1-piperazinyl)-1,2-Benzenediamine Related Literature
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Chen-Yu Chien,Sheng-Sheng Yu Chem. Commun., 2020,56, 11949-11952
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Huading Zhang,Lee R. Moore,Maciej Zborowski,P. Stephen Williams,Shlomo Margel,Jeffrey J. Chalmers Analyst, 2005,130, 514-527
-
Weili Dai,Guangjun Wu,Michael Hunger Chem. Commun., 2015,51, 13779-13782
-
Eric Besson,Stéphane Gastaldi,Emily Bloch,Selma Aslan,Hakim Karoui,Olivier Ouari,Micael Hardy Analyst, 2019,144, 4194-4203
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