Cas no 1261909-51-6 (2-Chloro-5-(4-chloro-3-methylphenyl)nicotinic acid)
1261909-51-6 structure
Product Name:2-Chloro-5-(4-chloro-3-methylphenyl)nicotinic acid
CAS No:1261909-51-6
MF:C13H9Cl2NO2
MW:282.122061491013
CID:2762823
PubChem ID:53223522
Update Time:2025-04-21
2-Chloro-5-(4-chloro-3-methylphenyl)nicotinic acid Chemical and Physical Properties
Names and Identifiers
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- DTXSID70687665
- 2-CHLORO-5-(4-CHLORO-3-METHYLPHENYL)NICOTINIC ACID
- MFCD18317653
- 1261909-51-6
- 2-Chloro-5-(4-chloro-3-methylphenyl)nicotinic acid, 95%
- 2-Chloro-5-(4-chloro-3-methylphenyl)nicotinic acid
-
- Inchi： 1S/C13H9Cl2NO2/c1-7-4-8(2-3-11(7)14)9-5-10(13(17)18)12(15)16-6-9/h2-6H,1H3,(H,17,18)
- InChI Key： NBJOGGKIXPTADM-UHFFFAOYSA-N
- SMILES： ClC1C=CC(=CC=1C)C1C=NC(=C(C(=O)O)C=1)Cl
Computed Properties
- Exact Mass: 281.0010339Da
- Monoisotopic Mass: 281.0010339Da
- Isotope Atom Count: 0
- Hydrogen Bond Donor Count: 1
- Hydrogen Bond Acceptor Count: 3
- Heavy Atom Count: 18
- Rotatable Bond Count: 2
- Complexity: 313
- 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: 4
- Topological Polar Surface Area: 50.2?2
2-Chloro-5-(4-chloro-3-methylphenyl)nicotinic acid Related Literature
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Zhiyan Chen,Nan Wu,Yaobing Wang,Bing Wang,Yingde Wang J. Mater. Chem. A, 2018,6, 516-526
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Ji-Ping Wei Nanoscale, 2015,7, 11815-11832
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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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Liao Xiaoqing,Li Ruiyi,Li Zaijun,Sun Xiulan,Wang Zhouping,Liu Junkang New J. Chem., 2015,39, 5240-5248
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