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Home > Boronic Acids > 932378-94-4
932378-94-4 | (3,5-bis(ethoxycarbonyl)phenyl)boronic acid
CAS No: 932378-94-4 Catalog No: AG019ENA MDL No:MFCD11867795
Product Description
Catalog Number:
AG019ENA
Chemical Name:
(3,5-bis(ethoxycarbonyl)phenyl)boronic acid
CAS Number:
932378-94-4
Molecular Formula:
C12H15BO6
Molecular Weight:
266.0549
MDL Number:
MFCD11867795
IUPAC Name:
[3,5-bis(ethoxycarbonyl)phenyl]boronic acid
InChI:
InChI=1S/C12H15BO6/c1-3-18-11(14)8-5-9(12(15)19-4-2)7-10(6-8)13(16)17/h5-7,16-17H,3-4H2,1-2H3
InChI Key:
XXBGYFGJSMAOSZ-UHFFFAOYSA-N
SMILES:
CCOC(=O)c1cc(cc(c1)C(=O)OCC)B(O)O
Properties
Complexity:
293
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
266.096g/mol
Formal Charge:
0
Heavy Atom Count:
19
Hydrogen Bond Acceptor Count:
6
Hydrogen Bond Donor Count:
2
Isotope Atom Count:
0
Molecular Weight:
266.056g/mol
Monoisotopic Mass:
266.096g/mol
Rotatable Bond Count:
7
Topological Polar Surface Area:
93.1A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
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