Cas no 647835-40-3 ([1,1':3',1''-Terphenyl]-2'-amine, 4,4''-dichloro-)
![[1,1':3',1''-Terphenyl]-2'-amine, 4,4''-dichloro- structure](https://ossimg.kuujia.com/scimg/648000/647835-40-3x500.png)
647835-40-3 structure
Product Name:[1,1':3',1''-Terphenyl]-2'-amine, 4,4''-dichloro-
CAS No:647835-40-3
MF:C18H13Cl2N
MW:314.208522558212
CID:417128
PubChem ID:71378795
Update Time:2025-04-19
[1,1':3',1''-Terphenyl]-2'-amine, 4,4''-dichloro- Chemical and Physical Properties
Names and Identifiers
-
- [1,1':3',1''-Terphenyl]-2'-amine, 4,4''-dichloro-
- 2,6-bis(4-chlorophenyl)aniline
- DTXSID40801396
- 647835-40-3
- 1~4~,3~4~-Dichloro[1~1~,2~1~:2~3~,3~1~-terphenyl]-2~2~-amine
-
- Inchi： 1S/C18H13Cl2N/c19-14-8-4-12(5-9-14)16-2-1-3-17(18(16)21)13-6-10-15(20)11-7-13/h1-11H,21H2
- InChI Key： VVLGCVUOLYIZNQ-UHFFFAOYSA-N
- SMILES： ClC1C=CC(=CC=1)C1C=CC=C(C2C=CC(=CC=2)Cl)C=1N
Computed Properties
- Exact Mass: 313.04269
- Monoisotopic Mass: 313.0425048g/mol
- Isotope Atom Count: 0
- Hydrogen Bond Donor Count: 1
- Hydrogen Bond Acceptor Count: 1
- Heavy Atom Count: 21
- Rotatable Bond Count: 2
- Complexity: 289
- 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: 5.7
- Topological Polar Surface Area: 26?2
Experimental Properties
- PSA: 26.02
[1,1':3',1''-Terphenyl]-2'-amine, 4,4''-dichloro- Related Literature
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Weixuan Zeng,Ouissam El Bakouri,Henrik Ottosson Chem. Sci., 2021,12, 6159-6171
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Tengfei Yu,Yuehan Wu,Wei Li,Bin Li RSC Adv., 2014,4, 34134-34143
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Christopher B. Rodell,Christopher B. Highley,Minna H. Chen,Neville N. Dusaj,Chao Wang,Lin Han,Jason A. Burdick Soft Matter, 2016,12, 7839-7847
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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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Lianqin Wang,Rachida Bance-Soualhi,Julia Ponce-González,Pilar Ocón,Edson A. Ticianelli,Daniel K. Whelligan,John R. Varcoe J. Mater. Chem. A, 2018,6, 24330-24341
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