4-Bromo-2-fluoro-5-nitrobenzaldehyde - CAS 679839-39-5
Catalog: |
BB033454 |
Product Name: |
4-Bromo-2-fluoro-5-nitrobenzaldehyde |
CAS: |
679839-39-5 |
Synonyms: |
4-bromo-2-fluoro-5-nitrobenzaldehyde; 4-bromo-2-fluoro-5-nitrobenzaldehyde |
IUPAC Name: | 4-bromo-2-fluoro-5-nitrobenzaldehyde |
Description: | 4-Bromo-2-fluoro-5-nitrobenzaldehyde (CAS# 679839-39-5) is a useful research chemical. |
Molecular Weight: | 248.01 |
Molecular Formula: | C7H3BrFNO3 |
Canonical SMILES: | C1=C(C(=CC(=C1[N+](=O)[O-])Br)F)C=O |
InChI: | InChI=1S/C7H3BrFNO3/c8-5-2-6(9)4(3-11)1-7(5)10(12)13/h1-3H |
InChI Key: | ZAROJBMUUUKZBH-UHFFFAOYSA-N |
LogP: | 2.83210 |
GHS Hazard Statement: | H302 (100%): Harmful if swallowed [Warning Acute toxicity, oral] |
Precautionary Statement: | P261, P264, P270, P271, P280, P301+P312, P302+P352, P304+P340, P305+P351+P338, P312, P321, P330, P332+P313, P337+P313, P362, P403+P233, P405, and P501 |
Signal Word: | Warning |
Publication Number | Title | Priority Date |
CN-112457295-A | Compound with Axl and c-Met kinase inhibitory activity and preparation and application thereof | 20190906 |
WO-2021043217-A1 | Compound having axl and c-met kinase inhibitory activity, preparation thereof and application thereof | 20190906 |
AU-2016341259-A1 | Pyridone derivatives and their use as kinase inhibitors | 20151022 |
AU-2016341259-B2 | Pyridone derivatives and their use as kinase inhibitors | 20151022 |
CA-3002875-A1 | Pyridone derivatives and their use as kinase inhibitors | 20151022 |
Complexity: | 220 |
Compound Is Canonicalized: | Yes |
Covalently-Bonded Unit Count: | 1 |
Defined Atom Stereocenter Count: | 0 |
Defined Bond Stereocenter Count: | 0 |
Exact Mass: | 246.92803 |
Formal Charge: | 0 |
Heavy Atom Count: | 13 |
Hydrogen Bond Acceptor Count: | 4 |
Hydrogen Bond Donor Count: | 0 |
Isotope Atom Count: | 0 |
Monoisotopic Mass: | 246.92803 |
Rotatable Bond Count: | 1 |
Topological Polar Surface Area: | 62.9 Å2 |
Undefined Atom Stereocenter Count: | 0 |
Undefined Bond Stereocenter Count: | 0 |
XLogP3: | 2 |
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