2-Bromobenzaldehyde diethyl acetal - CAS 35822-58-3
Catalog: |
BB022765 |
Product Name: |
2-Bromobenzaldehyde diethyl acetal |
CAS: |
35822-58-3 |
Synonyms: |
1-bromo-2-(diethoxymethyl)benzene |
IUPAC Name: | 1-bromo-2-(diethoxymethyl)benzene |
Description: | 2-Bromobenzaldehyde diethyl acetal (CAS# 35822-58-3) is a useful research chemical. |
Molecular Weight: | 259.14 |
Molecular Formula: | C11H15BrO2 |
Canonical SMILES: | CCOC(C1=CC=CC=C1Br)OCC |
InChI: | InChI=1S/C11H15BrO2/c1-3-13-11(14-4-2)9-7-5-6-8-10(9)12/h5-8,11H,3-4H2,1-2H3 |
InChI Key: | APDGYQVYBWGBSD-UHFFFAOYSA-N |
Boiling Point: | 116 °C (0.7 mmHg) |
Density: | 1.285 g/cm3 |
Appearance: | Colorless liquid |
MDL: | MFCD01075696 |
LogP: | 3.52070 |
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 |
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PMID | Publication Date | Title | Journal |
12971754 | 20030922 | Ruthenium complexes with chiral tetradentate imino-sulfoxide ligands | Inorganic chemistry |
Complexity: | 146 |
Compound Is Canonicalized: | Yes |
Covalently-Bonded Unit Count: | 1 |
Defined Atom Stereocenter Count: | 0 |
Defined Bond Stereocenter Count: | 0 |
Exact Mass: | 258.02554 |
Formal Charge: | 0 |
Heavy Atom Count: | 14 |
Hydrogen Bond Acceptor Count: | 2 |
Hydrogen Bond Donor Count: | 0 |
Isotope Atom Count: | 0 |
Monoisotopic Mass: | 258.02554 |
Rotatable Bond Count: | 5 |
Topological Polar Surface Area: | 18.5 Å2 |
Undefined Atom Stereocenter Count: | 0 |
Undefined Bond Stereocenter Count: | 0 |
XLogP3: | 3 |
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