Cas no 61576-87-2 (1,1':4',1''-Terphenyl, 2,3,4-trichloro-)
61576-87-2 structure
Product Name:1,1':4',1''-Terphenyl, 2,3,4-trichloro-
CAS No:61576-87-2
MF:C18H11Cl3
MW:333.63894200325
CID:474194
PubChem ID:19787048
Update Time:2025-04-19
1,1':4',1''-Terphenyl, 2,3,4-trichloro- Chemical and Physical Properties
Names and Identifiers
-
- 1,1':4',1''-Terphenyl, 2,3,4-trichloro-
- 1,2,3-trichloro-4-(4-phenylphenyl)benzene
- 1~2~,1~3~,1~4~-Trichloro-1~1~,2~1~:2~4~,3~1~-terphenyl
- 61576-87-2
- DTXSID40599908
-
- Inchi： 1S/C18H11Cl3/c19-16-11-10-15(17(20)18(16)21)14-8-6-13(7-9-14)12-4-2-1-3-5-12/h1-11H
- InChI Key： KMQSAZYBBKETLU-UHFFFAOYSA-N
- SMILES： ClC1C(=C(C=CC=1C1C=CC(=CC=1)C1C=CC=CC=1)Cl)Cl
Computed Properties
- Exact Mass: 331.99283
- Monoisotopic Mass: 331.992633g/mol
- Isotope Atom Count: 0
- Hydrogen Bond Donor Count: 0
- Hydrogen Bond Acceptor Count: 0
- Heavy Atom Count: 21
- Rotatable Bond Count: 2
- Complexity: 318
- 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: 7.5
- Topological Polar Surface Area: 0?2
Experimental Properties
- PSA: 0
1,1':4',1''-Terphenyl, 2,3,4-trichloro- Related Literature
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Chung-Sung Yang,Mong-Shian Shih,Fang-Yi Chang New J. Chem., 2006,30, 729-735
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Guiying Zhang,Maosheng Cheng,Yanni Li,Keliang Liu,Lifeng Cai Chem. Commun., 2013,49, 11086-11088
-
Shintaro Takata,Yoshihiro Miura Phys. Chem. Chem. Phys., 2014,16, 24784-24789
-
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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Eléonore Resongles,Corinne Casiot,Fran?oise Elbaz-Poulichet,Rémi Freydier,Odile Bruneel,Christine Piot,Sophie Delpoux,Aurélie Volant,Angélique Desoeuvre Environ. Sci.: Processes Impacts, 2013,15, 1536-1544
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