5-(4-Bromophenyl)furfural - CAS 20005-42-9
Catalog: |
BB015439 |
Product Name: |
5-(4-Bromophenyl)furfural |
CAS: |
20005-42-9 |
Synonyms: |
5-(4-bromophenyl)furan-2-carbaldehyde |
IUPAC Name: | 5-(4-bromophenyl)furan-2-carbaldehyde |
Description: | 5-(4-Bromophenyl)furfural (CAS# 20005-42-9) is a useful research chemical. |
Molecular Weight: | 251.08 |
Molecular Formula: | C11H7BrO2 |
Canonical SMILES: | C1=CC(=CC=C1C2=CC=C(O2)C=O)Br |
InChI: | InChI=1S/C11H7BrO2/c12-9-3-1-8(2-4-9)11-6-5-10(7-13)14-11/h1-7H |
InChI Key: | QRTAOOSYSVHQGT-UHFFFAOYSA-N |
Boiling Point: | 371.9 °C at 760 mmHg |
Density: | 1.518 g/cm3 |
Appearance: | Yellow red to deep yellow red powder |
MDL: | MFCD00239387 |
LogP: | 3.52160 |
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 |
CN-212924860-U | Furfural normal pressure hydrogenation vaporization system | 20200904 |
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Complexity: | 200 |
Compound Is Canonicalized: | Yes |
Covalently-Bonded Unit Count: | 1 |
Defined Atom Stereocenter Count: | 0 |
Defined Bond Stereocenter Count: | 0 |
Exact Mass: | 249.96294 |
Formal Charge: | 0 |
Heavy Atom Count: | 14 |
Hydrogen Bond Acceptor Count: | 2 |
Hydrogen Bond Donor Count: | 0 |
Isotope Atom Count: | 0 |
Monoisotopic Mass: | 249.96294 |
Rotatable Bond Count: | 2 |
Topological Polar Surface Area: | 30.2 Å2 |
Undefined Atom Stereocenter Count: | 0 |
Undefined Bond Stereocenter Count: | 0 |
XLogP3: | 3.1 |
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