Cas no 35727-83-4 (2,4-dichloro-6-[(2,4-dimethylphenyl)amino]benzene-1,3,5-tricarbonitrile)
![2,4-dichloro-6-[(2,4-dimethylphenyl)amino]benzene-1,3,5-tricarbonitrile structure](https://ossimg.kuujia.com/scimg/36000/35727-83-4x500.png)
35727-83-4 structure
Product Name:2,4-dichloro-6-[(2,4-dimethylphenyl)amino]benzene-1,3,5-tricarbonitrile
CAS No:35727-83-4
MF:C17H10Cl2N4
MW:341.194100856781
CID:1472167
PubChem ID:215465
Update Time:2025-04-20
2,4-dichloro-6-[(2,4-dimethylphenyl)amino]benzene-1,3,5-tricarbonitrile Chemical and Physical Properties
Names and Identifiers
-
- 2,4-dichloro-6-[(2,4-dimethylphenyl)amino]benzene-1,3,5-tricarbonitrile
- 2,4-dichloro-6-(2,4-dimethylanilino)benzene-1,3,5-tricarbonitrile
- 35727-83-4
- DTXSID20189260
- 4,6-Dichloro-2-(2,4-dimethylanilino)-1,3,5-benzenetricarbonitrile
- 1,3,5-Benzenetricarbonitrile, 4,6-dichloro-2-(2,4-dimethylanilino)-
- 4,6-Dichloro-2-(2,4-dimethylanilino)trimesonitrile
- CHEMBL3248180
- BRN 2782024
-
- Inchi： 1S/C17H10Cl2N4/c1-9-3-4-14(10(2)5-9)23-17-12(7-21)15(18)11(6-20)16(19)13(17)8-22/h3-5,23H,1-2H3
- InChI Key： FGTGXIRVSXMELR-UHFFFAOYSA-N
- SMILES： ClC1C(C#N)=C(C(C#N)=C(C=1C#N)NC1C=CC(C)=CC=1C)Cl
Computed Properties
- Exact Mass: 340.0285
- Monoisotopic Mass: 340.0282517g/mol
- Isotope Atom Count: 0
- Hydrogen Bond Donor Count: 1
- Hydrogen Bond Acceptor Count: 4
- Heavy Atom Count: 23
- Rotatable Bond Count: 2
- Complexity: 549
- 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: 5.2
- Topological Polar Surface Area: 83.4?2
Experimental Properties
- PSA: 83.4
2,4-dichloro-6-[(2,4-dimethylphenyl)amino]benzene-1,3,5-tricarbonitrile Related Literature
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Yingbo Li,Nada Mehio,Huizhou Liu,Sheng Dai Green Chem., 2015,17, 2981-2993
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Huiying Xu,Lu Zheng,Yu Zhou,Bang-Ce Ye Analyst, 2021,146, 5542-5549
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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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Tong Xu,Dongwei Ma,Chengbo Li,Qian Liu,Siyu Lu,Abdullah M. Asiri,Chun Yang,Xuping Sun Chem. Commun., 2020,56, 3673-3676
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Jieun Kim,Han-Saem Park,Tae-Hee Kim,Sung Yeol Kim,Hyun-Kon Song Phys. Chem. Chem. Phys., 2014,16, 5295-5300
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