Cas no 1286276-49-0 (5-Bromo-4-chloro nicotinic acid)
1286276-49-0 structure
Product Name:5-Bromo-4-chloro nicotinic acid
CAS No:1286276-49-0
MF:C6H3BrClNO2
MW:236.450519800186
CID:1226496
PubChem ID:57367943
Update Time:2025-04-20
5-Bromo-4-chloro nicotinic acid Chemical and Physical Properties
Names and Identifiers
-
- 5-Bromo-4-chloro nicotinic acid
- 5-bromo-4-chloropyridine-3-carboxylic acid
- AC-33278
- 5-bromo-4-chloronicotinicacid
- 1256790-85-8
- 1286276-49-0
- EN300-376037
- 3-Pyridinecarboxylic acid, 5-bromo-4-chloro-
- AKOS022186213
- 5-Bromo-4-chloronicotinic acid, AldrichCPR
- SY119612
- SCHEMBL3720517
- MFCD18257862
- C72015
- DTXSID001259290
- 5-Bromo-4-chloro-nicotinic acid
- DB-253376
- DB-368529
- A849301
- 5-bromo-4-chloronicotinic acid
- DS-7875
- AMY8072
-
- Inchi： 1S/C6H3BrClNO2/c7-4-2-9-1-3(5(4)8)6(10)11/h1-2H,(H,10,11)
- InChI Key： AEYIMKNQTWXCNI-UHFFFAOYSA-N
- SMILES： BrC1=CN=CC(C(=O)O)=C1Cl
Computed Properties
- Exact Mass: 234.90359
- Monoisotopic Mass: 234.90357g/mol
- Isotope Atom Count: 0
- Hydrogen Bond Donor Count: 1
- Hydrogen Bond Acceptor Count: 3
- Heavy Atom Count: 11
- Rotatable Bond Count: 1
- Complexity: 167
- 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: 1.7
- Topological Polar Surface Area: 50.2?2
Experimental Properties
- PSA: 50.19
5-Bromo-4-chloro nicotinic acid Related Literature
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1. An autonomous self-optimizing flow machine for the synthesis of pyridine–oxazoline (PyOX) ligands?Eric Wimmer,Daniel Cortés-Borda,Solène Brochard,Elvina Barré,Charlotte Truchet,Fran?ois-Xavier Felpin React. Chem. Eng., 2019,4, 1608-1615
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Kanjun Sun,Fengting Hua,Shuzhen Cui,Yanrong Zhu,Hui Peng,Guofu Ma RSC Adv., 2021,11, 37631-37642
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Huiying Xu,Lu Zheng,Yu Zhou,Bang-Ce Ye Analyst, 2021,146, 5542-5549
-
Jialiang Yuan,Ran Dong,Yuan Li,Yang Liu,Zhuo Zheng,Yuxia Liu,Yan Sun,Benhe Zhong,Zhenguo Wu,Xiaodong Guo Chem. Commun., 2021,57, 13004-13007
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Karl Crowley,Eimer O'Malley,Aoife Morrin,Malcolm R. Smyth,Anthony J. Killard Analyst, 2008,133, 391-399
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