4-Bromopyridine-2-carbaldehyde - CAS 131747-63-2
Catalog: |
BB007487 |
Product Name: |
4-Bromopyridine-2-carbaldehyde |
CAS: |
131747-63-2 |
Synonyms: |
4-bromo-2-pyridinecarboxaldehyde; 4-bromopyridine-2-carbaldehyde |
IUPAC Name: | 4-bromopyridine-2-carbaldehyde |
Description: | 4-Bromopyridine-2-carbaldehyde (CAS# 131747-63-2) is a reagent used to synthesize Curcumin (C838500) analogues. It can also be used to prepare 1,4-dihydropyridine calcium antagonists. |
Molecular Weight: | 186.01 |
Molecular Formula: | C6H4BrNO |
Canonical SMILES: | C1=CN=C(C=C1Br)C=O |
InChI: | InChI=1S/C6H4BrNO/c7-5-1-2-8-6(3-5)4-9/h1-4H |
InChI Key: | CKVQWOKUEZYWRQ-UHFFFAOYSA-N |
Boiling Point: | 243.976 °C at 760 mmHg |
Density: | 1.683 g/cm3 |
Appearance: | Yellow powder |
Storage: | Keep in dark place, Inert atmosphere, 2-8 °C |
MDL: | MFCD08690697 |
LogP: | 1.65660 |
GHS Hazard Statement: | H302 (100%): 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, P322, P330, P332+P313, P337+P313, P362, P363, P403+P233, P405, and P501 |
Signal Word: | Warning |
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Complexity: | 107 |
Compound Is Canonicalized: | Yes |
Covalently-Bonded Unit Count: | 1 |
Defined Atom Stereocenter Count: | 0 |
Defined Bond Stereocenter Count: | 0 |
Exact Mass: | 184.94763 |
Formal Charge: | 0 |
Heavy Atom Count: | 9 |
Hydrogen Bond Acceptor Count: | 2 |
Hydrogen Bond Donor Count: | 0 |
Isotope Atom Count: | 0 |
Monoisotopic Mass: | 184.94763 |
Rotatable Bond Count: | 1 |
Topological Polar Surface Area: | 30 Å2 |
Undefined Atom Stereocenter Count: | 0 |
Undefined Bond Stereocenter Count: | 0 |
XLogP3: | 1.3 |
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