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Home > Boronic Acids > 1189126-30-4
1189126-30-4 | (4-Ethoxy-3-methoxyphenyl);boronic acid
CAS No: 1189126-30-4 Catalog No: AG007R97 MDL No:MFCD20441840
Product Description
Catalog Number:
AG007R97
Chemical Name:
(4-Ethoxy-3-methoxyphenyl);boronic acid
CAS Number:
1189126-30-4
Molecular Formula:
C9H13BO4
Molecular Weight:
196.0081
MDL Number:
MFCD20441840
IUPAC Name:
(4-ethoxy-3-methoxyphenyl)boronic acid
InChI:
InChI=1S/C9H13BO4/c1-3-14-8-5-4-7(10(11)12)6-9(8)13-2/h4-6,11-12H,3H2,1-2H3
InChI Key:
CXTNPDZQQOJCFP-UHFFFAOYSA-N
SMILES:
CCOc1ccc(cc1OC)B(O)O
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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