Cas no 176433-64-0 (3-Pyridinecarbonylchloride, 6-chloro-5-formyl-)
176433-64-0 structure
Product Name:3-Pyridinecarbonylchloride, 6-chloro-5-formyl-
CAS No:176433-64-0
MF:C7H3Cl2NO2
MW:204.010219812393
CID:112373
PubChem ID:45081872
Update Time:2025-04-18
3-Pyridinecarbonylchloride, 6-chloro-5-formyl- Chemical and Physical Properties
Names and Identifiers
-
- 3-Pyridinecarbonylchloride, 6-chloro-5-formyl-
- 6-chloro-5-formylpyridine-3-carbonyl chloride
- 3-Pyridinecarbonyl chloride, 6-chloro-5-formyl- (9CI)
- DTXSID90664918
- 176433-64-0
- 3-Pyridinecarbonyl chloride,6-chloro-5-formyl-(9ci)
-
- Inchi： 1S/C7H3Cl2NO2/c8-6-5(3-11)1-4(2-10-6)7(9)12/h1-3H
- InChI Key： FHYQNGMWSXJRKA-UHFFFAOYSA-N
- SMILES： ClC1=C(C=O)C=C(C(=O)Cl)C=N1
Computed Properties
- Exact Mass: 202.95419
- Monoisotopic Mass: 202.954
- Isotope Atom Count: 0
- Hydrogen Bond Donor Count: 0
- Hydrogen Bond Acceptor Count: 3
- Heavy Atom Count: 12
- Rotatable Bond Count: 2
- Complexity: 198
- 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
- Topological Polar Surface Area: 47A^2
- XLogP3: 1.8
Experimental Properties
- PSA: 47.03
3-Pyridinecarbonylchloride, 6-chloro-5-formyl- Related Literature
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Bidyut Kumar Kundu,Rinky Singh,Ritudhwaj Tiwari,Debasis Nayak New J. Chem., 2019,43, 4867-4877
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Raheleh Torabi,Hedayatollah Ghourchian,Massoud Amanlou Org. Biomol. Chem., 2016,14, 8141-8153
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Andre Prates Pereira,Tao Dong,Eric P. Knoshaug,Nick Nagle,Ryan Spiller,Bonnie Panczak,Christopher J. Chuck,Philip T. Pienkos Sustainable Energy Fuels, 2020,4, 3400-3408
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Huiying Xu,Lu Zheng,Yu Zhou,Bang-Ce Ye Analyst, 2021,146, 5542-5549
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Jieun Kim,Han-Saem Park,Tae-Hee Kim,Sung Yeol Kim,Hyun-Kon Song Phys. Chem. Chem. Phys., 2014,16, 5295-5300
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