5-Bromo-2-fluoropyridine-3-carboxaldehyde - CAS 875781-15-0
Catalog: |
BB038529 |
Product Name: |
5-Bromo-2-fluoropyridine-3-carboxaldehyde |
CAS: |
875781-15-0 |
Synonyms: |
5-bromo-2-fluoro-3-pyridinecarboxaldehyde; 5-bromo-2-fluoropyridine-3-carbaldehyde |
IUPAC Name: | 5-bromo-2-fluoropyridine-3-carbaldehyde |
Description: | 5-Bromo-2-fluoropyridine-3-carboxaldehyde (CAS# 875781-15-0) is used in the synthesis of [2,3-d]pyrimidine derivatives useful as Raf kinase inhibitors. Also used in the preparation of XIa inhibitors. |
Molecular Weight: | 204.00 |
Molecular Formula: | C6H3BrFNO |
Canonical SMILES: | C1=C(C(=NC=C1Br)F)C=O |
InChI: | InChI=1S/C6H3BrFNO/c7-5-1-4(3-10)6(8)9-2-5/h1-3H |
InChI Key: | MUYVOGAJRCBWCY-UHFFFAOYSA-N |
Boiling Point: | 258.168 °C at 760 mmHg |
Density: | 1.778 g/cm3 |
LogP: | 1.79570 |
GHS Hazard Statement: | H302 (50%): Harmful if swallowed [Warning Acute toxicity, oral] |
Precautionary Statement: | P261, P264, P270, P271, P280, P301+P312, P302+P352, P304+P312, 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-113349212-A | Composition containing pyridalyl and tebuconazole | 20210708 |
WO-2021134004-A1 | Cyclic compounds and methods of using same | 20191227 |
WO-2021121282-A1 | Preparation and application of class of n-containing heterocyclic compounds with immunomodulatory function | 20191217 |
WO-2021011913-A1 | Tau-protein targeting compounds and associated methods of use | 20190717 |
US-2020392154-A1 | Pyridine carbamates and their use as glun2b receptor modulators | 20190614 |
Complexity: | 133 |
Compound Is Canonicalized: | Yes |
Covalently-Bonded Unit Count: | 1 |
Defined Atom Stereocenter Count: | 0 |
Defined Bond Stereocenter Count: | 0 |
Exact Mass: | 202.93820 |
Formal Charge: | 0 |
Heavy Atom Count: | 10 |
Hydrogen Bond Acceptor Count: | 3 |
Hydrogen Bond Donor Count: | 0 |
Isotope Atom Count: | 0 |
Monoisotopic Mass: | 202.93820 |
Rotatable Bond Count: | 1 |
Topological Polar Surface Area: | 30 Å2 |
Undefined Atom Stereocenter Count: | 0 |
Undefined Bond Stereocenter Count: | 0 |
XLogP3: | 1.4 |
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