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35822-58-3 | 1-Bromo-2-(diethoxymethyl)benzene
CAS No: 35822-58-3 Catalog No: AG003GRG MDL No:MFCD01075696
Product Description
Catalog Number:
AG003GRG
Chemical Name:
1-Bromo-2-(diethoxymethyl)benzene
CAS Number:
35822-58-3
Molecular Formula:
C11H15BrO2
Molecular Weight:
259.1396
MDL Number:
MFCD01075696
IUPAC Name:
1-bromo-2-(diethoxymethyl)benzene
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
SMILES:
CCOC(c1ccccc1Br)OCC
Properties
Complexity:
146
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
258.026g/mol
Formal Charge:
0
Heavy Atom Count:
14
Hydrogen Bond Acceptor Count:
2
Hydrogen Bond Donor Count:
0
Isotope Atom Count:
0
Molecular Weight:
259.143g/mol
Monoisotopic Mass:
258.026g/mol
Rotatable Bond Count:
5
Topological Polar Surface Area:
18.5A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
3
Literature
| Title | Journal |
|---|---|
| Ruthenium complexes with chiral tetradentate imino-sulfoxide ligands. | Inorganic chemistry 20030922 |
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