Cas no 180798-50-9 (4-Chloro-2,6-difluoro-1,1'-biphenyl)
180798-50-9 structure
Product Name:4-Chloro-2,6-difluoro-1,1'-biphenyl
CAS No:180798-50-9
MF:C12H7ClF2
MW:224.633789300919
CID:2783282
Update Time:2023-08-07
4-Chloro-2,6-difluoro-1,1'-biphenyl Chemical and Physical Properties
Names and Identifiers
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- 4-Chloro-2,6-difluoro-1,1'-biphenyl
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- Inchi： 1S/C12H7ClF2/c13-9-6-10(14)12(11(15)7-9)8-4-2-1-3-5-8/h1-7H
- InChI Key： COZCRGLGVVMMNI-UHFFFAOYSA-N
- SMILES： ClC1C=C(C(=C(C=1)F)C1C=CC=CC=1)F
Computed Properties
- Hydrogen Bond Donor Count: 0
- Hydrogen Bond Acceptor Count: 2
- Heavy Atom Count: 15
- Rotatable Bond Count: 1
- Complexity: 192
- XLogP3: 4.7
- Topological Polar Surface Area: 0
4-Chloro-2,6-difluoro-1,1'-biphenyl Related Literature
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Craig A. Kelly,David R. Rosseinsky Phys. Chem. Chem. Phys., 2001,3, 2086-2090
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Yi Cao,Yujiao Xiahou,Lixiang Xing,Xiang Zhang,Hong Li,ChenShou Wu,Haibing Xia Nanoscale, 2020,12, 20456-20466
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Max Attwood,Hiroki Akutsu,Lee Martin,Toby J. Blundell,Pierre Le Maguere,Scott S. Turner Dalton Trans., 2021,50, 11843-11851
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Peiyuan Zeng,Xiaoxiao Wang,Ming Ye,Qiuyang Ma,Jianwen Li,Wanwan Wang,Baoyou Geng,Zhen Fang RSC Adv., 2016,6, 23074-23084
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Xing Zhao,Lu Bai,Rui-Ying Bao,Zheng-Ying Liu,Ming-Bo Yang,Wei Yang RSC Adv., 2017,7, 46297-46305
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