Cas no 68944-99-0 (Benzenamine, 4-[4-(4-methylphenyl)-1-piperazinyl]-)
![Benzenamine, 4-[4-(4-methylphenyl)-1-piperazinyl]- structure](https://ossimg.kuujia.com/scimg/69000/68944-99-0x500.png)
68944-99-0 structure
Product Name:Benzenamine, 4-[4-(4-methylphenyl)-1-piperazinyl]-
CAS No:68944-99-0
MF:C17H21N3
MW:267.368743658066
CID:1731263
PubChem ID:12493530
Update Time:2025-04-21
Benzenamine, 4-[4-(4-methylphenyl)-1-piperazinyl]- Chemical and Physical Properties
Names and Identifiers
-
- Benzenamine, 4-[4-(4-methylphenyl)-1-piperazinyl]-
- 1-(4-METHYLPHENYL)-4-(4-AMINOPHENYL ) PIPERAZINE
- 4-[4-(4-Methylphenyl)-1-piperazinyl]benzenamine
- 68944-99-0
- AKOS025212968
- 4-[4-(4-methylphenyl)piperazin-1-yl]aniline
- DTXSID001242550
- SCHEMBL12240582
- 1-(4-methylphenyl)-4-(4-aminophenyl)piperazine
-
- Inchi： 1S/C17H21N3/c1-14-2-6-16(7-3-14)19-10-12-20(13-11-19)17-8-4-15(18)5-9-17/h2-9H,10-13,18H2,1H3
- InChI Key： MGGCITJJRCVQFG-UHFFFAOYSA-N
- SMILES： N1(C2C=CC(C)=CC=2)CCN(C2C=CC(=CC=2)N)CC1
Computed Properties
- Exact Mass: 267.17373
- Monoisotopic Mass: 267.173547683g/mol
- Isotope Atom Count: 0
- Hydrogen Bond Donor Count: 1
- Hydrogen Bond Acceptor Count: 3
- Heavy Atom Count: 20
- Rotatable Bond Count: 2
- Complexity: 283
- 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: 3.3
- Topological Polar Surface Area: 32.5?2
Experimental Properties
- PSA: 32.5
Benzenamine, 4-[4-(4-methylphenyl)-1-piperazinyl]- Related Literature
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Jason Y. C. Lim,Yong Yu,Guorui Jin,Kai Li,Yi Lu,Jianping Xie Nanoscale Adv., 2020,2, 3921-3932
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Craig A. Kelly,David R. Rosseinsky Phys. Chem. Chem. Phys., 2001,3, 2086-2090
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Shintaro Takata,Yoshihiro Miura Phys. Chem. Chem. Phys., 2014,16, 24784-24789
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Thi Thu Tram Nguyen,Thanh Binh Nguyen Org. Biomol. Chem., 2021,19, 6015-6020
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Chen-Yu Chien,Sheng-Sheng Yu Chem. Commun., 2020,56, 11949-11952
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