| CAS Number | 1256792-34-3 |
| Catalog Number | AG000OD8(AGN-PC-0WAGYI) |
| Chemical Name | 3-Fluoro-5-methoxyisonicotinaldehyde |
| IUPAC Name | 3-fluoro-5-methoxypyridine-4-carbaldehyde |
| InChI | InChI=1S/C7H6FNO2/c1-11-7-3-9-2-6(8)5(7)4-10/h2-4H,1H3 |
| InChI Key | UQXMVPSXSNPVKK-UHFFFAOYSA-N |
| MDL Number | MFCD18258153 |
| Molecular Formula | C7H6FNO2 |
| Molecular Weight | 155.1264 |
| SMILES | COc1cncc(F)c1C=O |
| Synonyms | 3-Fluoro-5-methoxyisonicotinaldehyde,
1256792-34-3,
AK160895,
3-fluoro-5-methoxypyridine-4-carbaldehyde,
SCHEMBL18297672,
ZINC98181693,
AKOS024463689,
FCH1150173,
AJ-142800,
AX8293930,
ST24042182,
4-Pyridinecarboxaldehyde, 3-fluoro-5-methoxy-,
|
| Complexity | 142 |
| Compound Is Canonicalized | Yes |
| Covalently-Bonded Unit Count | 1 |
| Defined Atom Stereocenter Count | 0 |
| Defined Bond Stereocenter Count | 0 |
| Exact Mass | 155.038g/mol |
| Formal Charge | 0 |
| Heavy Atom Count | 11 |
| Hydrogen Bond Acceptor Count | 4 |
| Hydrogen Bond Donor Count | 0 |
| Isotope Atom Count | 0 |
| Molecular Weight | 155.128g/mol |
| Monoisotopic Mass | 155.038g/mol |
| Rotatable Bond Count | 2 |
| Topological Polar Surface Area | 39.2A^2 |
| Undefined Atom Stereocenter Count | 0 |
| Undefined Bond Stereocenter Count | 0 |
| XLogP3 | 0.4 |
GHS Hazard and Precautionary Statements
| Symbol: |  |
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Hazard Class
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\N
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Hazard statements
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H302
|
|
Packing Group
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\N
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Precautionary statements
|
P261-P280-P305+P351+P338-P304+P340-P405-P501
|
|
UN Code
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\N
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Certificate of Analysis
Lot Number