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Home > Boronic Acids > 72316-18-8
72316-18-8 | trans-2-(4-methoxyphenyl)vinylboronic acid
CAS No: 72316-18-8 Catalog No: AG0067OI MDL No:MFCD04039879
Product Description
Catalog Number:
AG0067OI
Chemical Name:
trans-2-(4-methoxyphenyl)vinylboronic acid
CAS Number:
72316-18-8
Molecular Formula:
C9H11BO3
Molecular Weight:
177.9928
MDL Number:
MFCD04039879
IUPAC Name:
[(E)-2-(4-methoxyphenyl)ethenyl]boronic acid
InChI:
InChI=1S/C9H11BO3/c1-13-9-4-2-8(3-5-9)6-7-10(11)12/h2-7,11-12H,1H3/b7-6+
InChI Key:
LGSBCAPDUJYMOQ-VOTSOKGWSA-N
SMILES:
COc1ccc(cc1)/C=C/B(O)O
Properties
Complexity:
162
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
1
Exact Mass:
178.08g/mol
Formal Charge:
0
Heavy Atom Count:
13
Hydrogen Bond Acceptor Count:
3
Hydrogen Bond Donor Count:
2
Isotope Atom Count:
0
Molecular Weight:
177.994g/mol
Monoisotopic Mass:
178.08g/mol
Rotatable Bond Count:
3
Topological Polar Surface Area:
49.7A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
Literature
| Title | Journal |
|---|---|
| Metal-free carbon-carbon bond-forming reductive coupling between boronic acids and tosylhydrazones. | Nature chemistry 20090901 |
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