Cas no 1420838-29-4 (1-(2-Chloropyridin-4-yl)propane-1,3-diol)
1420838-29-4 structure
Product Name:1-(2-Chloropyridin-4-yl)propane-1,3-diol
CAS No:1420838-29-4
MF:C8H10ClNO2
MW:187.623501300812
CID:2182058
Update Time:2023-08-06
1-(2-Chloropyridin-4-yl)propane-1,3-diol Chemical and Physical Properties
Names and Identifiers
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- 1-(2-Chloropyridin-4-yl)propane-1,3-diol
- AM98599
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- Inchi： 1S/C8H10ClNO2/c9-8-5-6(1-3-10-8)7(12)2-4-11/h1,3,5,7,11-12H,2,4H2
- InChI Key： IAHIFFJMNLIFIL-UHFFFAOYSA-N
- SMILES： ClC1C=C(C=CN=1)C(CCO)O
Computed Properties
- Hydrogen Bond Donor Count: 2
- Hydrogen Bond Acceptor Count: 3
- Heavy Atom Count: 12
- Rotatable Bond Count: 3
- Complexity: 134
- Topological Polar Surface Area: 53.4
1-(2-Chloropyridin-4-yl)propane-1,3-diol Related Literature
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Manickam Bakthadoss,Tadiparthi Thirupathi Reddy,Vishal Agarwal,Duddu S. Sharada Chem. Commun., 2022,58, 1406-1409
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Jonas Kind,Lukas Kaltschnee,Martin Leyendecker,Christina M. Thiele Chem. Commun., 2016,52, 12506-12509
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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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