Cas no 100958-67-6 (4-Methyl-2-pyridinecarbaldehyde 1-oxide)
100958-67-6 structure
Product Name:4-Methyl-2-pyridinecarbaldehyde 1-oxide
CAS No:100958-67-6
MF:C7H7NO2
MW:137.135981798172
CID:893021
Update Time:2023-08-02
4-Methyl-2-pyridinecarbaldehyde 1-oxide Chemical and Physical Properties
Names and Identifiers
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- Picolinaldehyde, 4-methyl-, 1-oxide (6CI)
- 4-Methyl-2-pyridinecarbaldehyde 1-oxide
-
- Inchi： 1S/C7H7NO2/c1-6-2-3-8(10)7(4-6)5-9/h2-5H,1H3
- InChI Key： JLTIDSRQLSQESK-UHFFFAOYSA-N
- SMILES： [O-][N+]1C=CC(C)=CC=1C=O
Computed Properties
- Hydrogen Bond Donor Count: 0
- Hydrogen Bond Acceptor Count: 2
- Heavy Atom Count: 10
- Rotatable Bond Count: 1
- Complexity: 127
- Topological Polar Surface Area: 42.5
4-Methyl-2-pyridinecarbaldehyde 1-oxide Related Literature
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Joseph W. Bennett,Diamond T. Jones,Blake G. Hudson,Joshua Melendez-Rivera,Robert J. Hamers,Sara E. Mason Environ. Sci.: Nano, 2020,7, 1642-1651
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Matthew J. Gaunt,Jinquan Yu,Jonathan B. Spencer Chem. Commun., 2001, 1844-1845
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Eunju Nam,Jiyeon Han,Sunhee Choi,Mi Hee Lim Chem. Commun., 2021,57, 7637-7640
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