Cas no 1227585-40-1 (2-chloro-4-(chloromethyl)pyridin-3-ol)
1227585-40-1 structure
Product Name:2-chloro-4-(chloromethyl)pyridin-3-ol
CAS No:1227585-40-1
MF:C6H5Cl2NO
MW:178.015999555588
CID:2618196
PubChem ID:72212827
Update Time:2025-04-21
2-chloro-4-(chloromethyl)pyridin-3-ol Chemical and Physical Properties
Names and Identifiers
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- 2-chloro-4-(chloromethyl)pyridin-3-ol
- AB71002
- 1227585-40-1
-
- Inchi: 1S/C6H5Cl2NO/c7-3-4-1-2-9-6(8)5(4)10/h1-2,10H,3H2
- InChI Key: FLVHYSCNVJDIGD-UHFFFAOYSA-N
- SMILES: ClCC1C=CN=C(C=1O)Cl
Computed Properties
- Exact Mass: 176.9748192Da
- Monoisotopic Mass: 176.9748192Da
- Isotope Atom Count: 0
- Hydrogen Bond Donor Count: 1
- Hydrogen Bond Acceptor Count: 2
- Heavy Atom Count: 10
- Rotatable Bond Count: 1
- Complexity: 112
- 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: 1.8
- Topological Polar Surface Area: 33.1?2
2-chloro-4-(chloromethyl)pyridin-3-ol Related Literature
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Jacob S. Jordan,Evan R. Williams Analyst, 2021,146, 2617-2625
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Amit Kumar Majhi,Subbarao Kanchi,V. Venkataraman,K. G. Ayappa,Prabal K. Maiti Soft Matter, 2015,11, 8632-8640
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Chung-Sung Yang,Mong-Shian Shih,Fang-Yi Chang New J. Chem., 2006,30, 729-735
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