Cas no 1335218-34-2 (5-Bromo-2-(6-chloropyridin-3-yloxy)benzoic acid)
1335218-34-2 structure
Product Name:5-Bromo-2-(6-chloropyridin-3-yloxy)benzoic acid
CAS No:1335218-34-2
MF:C12H7BrClNO3
MW:328.545881509781
CID:2124779
Update Time:2023-08-04
5-Bromo-2-(6-chloropyridin-3-yloxy)benzoic acid Chemical and Physical Properties
Names and Identifiers
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- 5-bromo-2-[(6-chloro-3-pyridinyl)oxy]Benzoic acid
- RBGJAVNMRGMIFY-UHFFFAOYSA-N
- 5-bromo-2-(6-chloropyridin-3-yloxy)benzoic acid
- Benzoicacid,5-bromo-2-[(6-chloro-3-pyridinyl)oxy]-
- Benzoic acid, 5-bromo-2-[(6-chloro-3-pyridinyl)oxy]-
- 5-Bromo-2-(6-chloropyridin-3-yloxy)benzoic acid
-
- Inchi： 1S/C12H7BrClNO3/c13-7-1-3-10(9(5-7)12(16)17)18-8-2-4-11(14)15-6-8/h1-6H,(H,16,17)
- InChI Key： RBGJAVNMRGMIFY-UHFFFAOYSA-N
- SMILES： BrC1C=CC(=C(C(=O)O)C=1)OC1C=NC(=CC=1)Cl
Computed Properties
- Hydrogen Bond Donor Count: 1
- Hydrogen Bond Acceptor Count: 4
- Heavy Atom Count: 18
- Rotatable Bond Count: 3
- Complexity: 305
- Topological Polar Surface Area: 59.4
5-Bromo-2-(6-chloropyridin-3-yloxy)benzoic acid Related Literature
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Huabin Zhang,Shaowu Du CrystEngComm, 2014,16, 4059-4068
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Rongyan Guo,Tao Li,Shuie Shi J. Mater. Chem. C, 2019,7, 5148-5154
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Kaiyuan Huang,Wangkang Qiu,Meilian Ou,Xiaorui Liu,Zenan Liao,Sheng Chu RSC Adv., 2020,10, 18824-18829
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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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Yingbo Li,Nada Mehio,Huizhou Liu,Sheng Dai Green Chem., 2015,17, 2981-2993
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