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Home > Boronic Acids > 551001-79-7
551001-79-7 | 5-methoxybenzofuran-2-ylboronic acid
CAS No: 551001-79-7 Catalog No: AG00DG1A MDL No:MFCD06801701
Product Description
Catalog Number:
AG00DG1A
Chemical Name:
5-methoxybenzofuran-2-ylboronic acid
CAS Number:
551001-79-7
Molecular Formula:
C9H9BO4
Molecular Weight:
191.9764
MDL Number:
MFCD06801701
IUPAC Name:
(5-methoxy-1-benzofuran-2-yl)boronic acid
InChI:
InChI=1S/C9H9BO4/c1-13-7-2-3-8-6(4-7)5-9(14-8)10(11)12/h2-5,11-12H,1H3
InChI Key:
XLIQZZGLIJLKTF-UHFFFAOYSA-N
SMILES:
COc1ccc2c(c1)cc(o2)B(O)O
Properties
Complexity:
199
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
192.059g/mol
Formal Charge:
0
Heavy Atom Count:
14
Hydrogen Bond Acceptor Count:
4
Hydrogen Bond Donor Count:
2
Isotope Atom Count:
0
Molecular Weight:
191.977g/mol
Monoisotopic Mass:
192.059g/mol
Rotatable Bond Count:
2
Topological Polar Surface Area:
62.8A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
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