Cas no 478148-81-1 (2-PYRIDINEMETHANOL, 6-CHLORO-4-IODO-5-(2-PROPENYLOXY)-)
478148-81-1 structure
Product Name:2-PYRIDINEMETHANOL, 6-CHLORO-4-IODO-5-(2-PROPENYLOXY)-
CAS No:478148-81-1
MF:C9H9ClINO2
MW:325.530733823776
CID:3275057
PubChem ID:22047032
Update Time:2025-04-21
2-PYRIDINEMETHANOL, 6-CHLORO-4-IODO-5-(2-PROPENYLOXY)- Chemical and Physical Properties
Names and Identifiers
-
- 2-PYRIDINEMETHANOL, 6-CHLORO-4-IODO-5-(2-PROPENYLOXY)-
- 3-(allyloxy)-2-chloro-6-(hydroxymethyl)-4-iodopyridine
- 478148-81-1
- DB-399497
- SCHEMBL844045
- YSMXJEKOIIULPX-UHFFFAOYSA-N
- 6-Chloro-4-iodo-5-(2-propen-1-yloxy)-2-pyridinemethanol
-
- Inchi： 1S/C9H9ClINO2/c1-2-3-14-8-7(11)4-6(5-13)12-9(8)10/h2,4,13H,1,3,5H2
- InChI Key： YSMXJEKOIIULPX-UHFFFAOYSA-N
- SMILES： IC1=CC(CO)=NC(=C1OCC=C)Cl
Computed Properties
- Exact Mass: 324.93665Da
- Monoisotopic Mass: 324.93665Da
- Isotope Atom Count: 0
- Hydrogen Bond Donor Count: 1
- Hydrogen Bond Acceptor Count: 3
- Heavy Atom Count: 14
- Rotatable Bond Count: 4
- Complexity: 194
- 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: 2.2
- Topological Polar Surface Area: 42.4?2
2-PYRIDINEMETHANOL, 6-CHLORO-4-IODO-5-(2-PROPENYLOXY)- Related Literature
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Domenico Lombardo,Gianmarco Munaò,Pietro Calandra,Luigi Pasqua,Maria Teresa Caccamo Phys. Chem. Chem. Phys., 2019,21, 11983-11991
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J. Zagora,M. Vosla?,L. Schreiberová,I. Schreiber Phys. Chem. Chem. Phys., 2002,4, 1284-1291
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Zhixia Liu,Tingjian Chen,Floyd E. Romesberg Chem. Sci., 2017,8, 8179-8182
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Ana G. Neo,Ana Bornadiego,Jesús Díaz,Stefano Marcaccini,Carlos F. Marcos Org. Biomol. Chem., 2013,11, 6546-6555
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5. Estimation of hydrogen sulfide from crude petroleum: a unique invention using a simple chemosensor?Shampa Kundu,Prithidipa Sahoo New J. Chem., 2019,43, 12369-12374
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