2,4-Dibromopyridine-3-carboxaldehyde - CAS 128071-91-0
Catalog: |
BB006865 |
Product Name: |
2,4-Dibromopyridine-3-carboxaldehyde |
CAS: |
128071-91-0 |
Synonyms: |
2,4-dibromopyridine-3-carbaldehyde |
IUPAC Name: | 2,4-dibromopyridine-3-carbaldehyde |
Description: | 2,4-Dibromopyridine-3-carboxaldehyde (CAS# 128071-91-0) is a useful research chemical. |
Molecular Weight: | 264.90 |
Molecular Formula: | C6H3Br2NO |
Canonical SMILES: | C1=CN=C(C(=C1Br)C=O)Br |
InChI: | InChI=1S/C6H3Br2NO/c7-5-1-2-9-6(8)4(5)3-10/h1-3H |
InChI Key: | TXLALYLVGBOCHK-UHFFFAOYSA-N |
Boiling Point: | 313.4 °C at 760 mmHg |
Purity: | 95 % |
Density: | 2.09 g/cm3 |
Storage: | Keep in dark place, Inert atmosphere, 2-8 °C |
LogP: | 2.41910 |
GHS Hazard Statement: | H301 (100%): Toxic if swallowed [Danger Acute toxicity, oral]; H315 (100%): Causes skin irritation [Warning Skin corrosion/irritation]; H319 (100%): Causes serious eye irritation [Warning Serious eye damage/eye irritation]; H335 (100%): May cause respiratory irritation [Warning Specific target organ toxicity, single exposure; Respiratory tract irritation] |
Precautionary Statement: | P261, P264, P264+P265, P270, P271, P280, P301+P316, P302+P352, P304+P340, P305+P351+P338, P319, P321, P330, P332+P317, P337+P317, P362+P364, P403+P233, P405, and P501 |
Signal Word: | Danger |
Publication Number | Title | Priority Date |
WO-2021066958-A1 | Inhibitor of btk and mutants thereof | 20191005 |
WO-2020176403-A1 | Inhibitor of btk and mutants thereof | 20190225 |
Complexity: | 131 |
Compound Is Canonicalized: | Yes |
Covalently-Bonded Unit Count: | 1 |
Defined Atom Stereocenter Count: | 0 |
Defined Bond Stereocenter Count: | 0 |
Exact Mass: | 264.85609 |
Formal Charge: | 0 |
Heavy Atom Count: | 10 |
Hydrogen Bond Acceptor Count: | 2 |
Hydrogen Bond Donor Count: | 0 |
Isotope Atom Count: | 0 |
Monoisotopic Mass: | 262.85814 |
Rotatable Bond Count: | 1 |
Topological Polar Surface Area: | 30 |
Undefined Atom Stereocenter Count: | 0 |
Undefined Bond Stereocenter Count: | 0 |
XLogP3: | 2 |
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