5-(Bromomethyl)-2-fluoropyridine - CAS 105827-74-5
Catalog: |
BB001727 |
Product Name: |
5-(Bromomethyl)-2-fluoropyridine |
CAS: |
105827-74-5 |
Synonyms: |
5-(bromomethyl)-2-fluoropyridine; 5-(bromomethyl)-2-fluoropyridine |
IUPAC Name: | 5-(bromomethyl)-2-fluoropyridine |
Description: | 5-(Bromomethyl)-2-fluoropyridine (CAS# 105827-74-5) is a useful reagent for preparation of N-Benzylisatinsulfonamides as potent CASpase-3 inhibitors. |
Molecular Weight: | 190.01 |
Molecular Formula: | C6H5BrFN |
Canonical SMILES: | C1=CC(=NC=C1CBr)F |
InChI: | InChI=1S/C6H5BrFN/c7-3-5-1-2-6(8)9-4-5/h1-2,4H,3H2 |
InChI Key: | IUJPAAPIEURDEZ-UHFFFAOYSA-N |
Storage: | Inert atmosphere, Store in freezer, under -20 °C |
LogP: | 2.11560 |
GHS Hazard Statement: | H315 (100%): Causes skin irritation [Warning Skin corrosion/irritation] |
Precautionary Statement: | P261, P264, P271, P280, P302+P352, P304+P340, P305+P351+P338, P312, P321, P332+P313, P337+P313, P362, P403+P233, P405, and P501 |
Signal Word: | Warning |
Publication Number | Title | Priority Date |
US-2021188827-A1 | Atm kinase inhibitors and compositions and methods of use thereof | 20191204 |
WO-2021113506-A1 | Atm kinase inhibitors and compositions and methods of use thereof | 20191204 |
KR-102215255-B1 | Novel compounds useful as fluorescent probes selectively binding to tau aggregates and preparation method thereof | 20190612 |
KR-20200142215-A | Novel compounds useful as fluorescent probes selectively binding to tau aggregates and preparation method thereof | 20190612 |
WO-2020138398-A1 | Novel compound inhibiting lysine-specific demethylating enzyme 1, method for producing same, and use of same | 20181228 |
Complexity: | 89.1 |
Compound Is Canonicalized: | Yes |
Covalently-Bonded Unit Count: | 1 |
Defined Atom Stereocenter Count: | 0 |
Defined Bond Stereocenter Count: | 0 |
Exact Mass: | 188.95894 |
Formal Charge: | 0 |
Heavy Atom Count: | 9 |
Hydrogen Bond Acceptor Count: | 2 |
Hydrogen Bond Donor Count: | 0 |
Isotope Atom Count: | 0 |
Monoisotopic Mass: | 188.95894 |
Rotatable Bond Count: | 1 |
Topological Polar Surface Area: | 12.9 Å2 |
Undefined Atom Stereocenter Count: | 0 |
Undefined Bond Stereocenter Count: | 0 |
XLogP3: | 1.8 |
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