Cas no 185423-27-2 (4-Pyridinecarboxaldehyde, 3-(acetyloxy)-2,6-dichloro-)
185423-27-2 structure
Product Name:4-Pyridinecarboxaldehyde, 3-(acetyloxy)-2,6-dichloro-
CAS No:185423-27-2
MF:C8H5Cl2NO3
MW:234.036200284958
CID:3828456
PubChem ID:85708458
Update Time:2025-04-22
4-Pyridinecarboxaldehyde, 3-(acetyloxy)-2,6-dichloro- Chemical and Physical Properties
Names and Identifiers
-
- 4-Pyridinecarboxaldehyde, 3-(acetyloxy)-2,6-dichloro-
- DTXSID401222574
- 3-(Acetyloxy)-2,6-dichloro-4-pyridinecarboxaldehyde
- 185423-27-2
-
- Inchi： 1S/C8H5Cl2NO3/c1-4(13)14-7-5(3-12)2-6(9)11-8(7)10/h2-3H,1H3
- InChI Key： IGCLPSBUOXUXOL-UHFFFAOYSA-N
- SMILES： C1(Cl)=NC(Cl)=CC(C=O)=C1OC(C)=O
Computed Properties
- Exact Mass: 232.9646484Da
- Monoisotopic Mass: 232.9646484Da
- Isotope Atom Count: 0
- Hydrogen Bond Donor Count: 0
- Hydrogen Bond Acceptor Count: 4
- Heavy Atom Count: 14
- Rotatable Bond Count: 3
- Complexity: 237
- 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: 2
- Topological Polar Surface Area: 56.3?2
4-Pyridinecarboxaldehyde, 3-(acetyloxy)-2,6-dichloro- Related Literature
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Alexandre Vimont,Arnaud Travert,Philippe Bazin,Jean-Claude Lavalley,Marco Daturi,Christian Serre,Gérard Férey,Sandrine Bourrelly,Philip L. Llewellyn Chem. Commun., 2007, 3291-3293
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M. Zeiger,N. J?ckel,P. Strubel,L. Borchardt,R. Reinhold,W. Nickel,J. Eckert,V. Presser,S. Kaskel J. Mater. Chem. A, 2015,3, 17983-17990
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Christopher J. Harrison,Kyle J. Berean,Enrico Della Gaspera,Jian Zhen Ou,Richard B. Kaner,Kourosh Kalantar-zadeh,Torben Daeneke Nanoscale, 2016,8, 16276-16283
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Ivor Lon?ari? Phys. Chem. Chem. Phys., 2015,17, 9436-9445
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Chao-Han Cheng,Wen-Zhen Wang,Shie-Ming Peng,I-Chia Chen Phys. Chem. Chem. Phys., 2017,19, 25471-25477
185423-27-2 (4-Pyridinecarboxaldehyde, 3-(acetyloxy)-2,6-dichloro-) Related Products
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