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Home > Boronic Acids > 957065-85-9
957065-85-9 | 2-Ethoxy-5-methoxyphenylboronic acid
CAS No: 957065-85-9 Catalog No: AG005YDL MDL No:MFCD09878346
Product Description
Catalog Number:
AG005YDL
Chemical Name:
2-Ethoxy-5-methoxyphenylboronic acid
CAS Number:
957065-85-9
Molecular Formula:
C9H13BO4
Molecular Weight:
196.0081
MDL Number:
MFCD09878346
IUPAC Name:
(2-ethoxy-5-methoxyphenyl)boronic acid
InChI:
InChI=1S/C9H13BO4/c1-3-14-9-5-4-7(13-2)6-8(9)10(11)12/h4-6,11-12H,3H2,1-2H3
InChI Key:
QZURUWKQPQTXPR-UHFFFAOYSA-N
SMILES:
CCOc1ccc(cc1B(O)O)OC
Properties
Complexity:
165
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
196.091g/mol
Formal Charge:
0
Heavy Atom Count:
14
Hydrogen Bond Acceptor Count:
4
Hydrogen Bond Donor Count:
2
Isotope Atom Count:
0
Molecular Weight:
196.009g/mol
Monoisotopic Mass:
196.091g/mol
Rotatable Bond Count:
4
Topological Polar Surface Area:
58.9A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
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