Home Boronic Acids 1003042-89-4
1003042-89-4,MFCD22421490
Catalog No.:AA0001GW
1003042-89-4 | Boronic acid, B-(5-ethoxy-2-formylphenyl)-
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Quantity
  
1g
98%
in stock  
$120.00
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5g
98%
in stock  
$423.00
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10g
98%
in stock  
$712.00
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Technical Information
Catalog Number:
AA0001GW
Chemical Name:
Boronic acid, B-(5-ethoxy-2-formylphenyl)-
CAS Number:
1003042-89-4
Molecular Formula:
C9H11BO4
Molecular Weight:
193.9922
MDL Number:
MFCD22421490
IUPAC Name:
(5-ethoxy-2-formylphenyl)boronic acid
InChI:
InChI=1S/C9H11BO4/c1-2-14-8-4-3-7(6-11)9(5-8)10(12)13/h3-6,12-13H,2H2,1H3
InChI Key:
WZXOCGHYGPWDRF-UHFFFAOYSA-N
SMILES:
CCOc1ccc(c(c1)B(O)O)C=O
Properties
Computed Properties
 
Complexity:
186  
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1  
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
194.075g/mol
Formal Charge:
0
Heavy Atom Count:
14  
Hydrogen Bond Acceptor Count:
4  
Hydrogen Bond Donor Count:
2  
Isotope Atom Count:
0
Molecular Weight:
193.993g/mol
Monoisotopic Mass:
194.075g/mol
Rotatable Bond Count:
4  
Topological Polar Surface Area:
66.8A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0

Synonyms
 
(5-Ethoxy-2-formylphenyl)boronic acid 
1003042-89-4 
5-Ethoxy-2-formylphenylboronic acid 
AKOS024262353 
ZINC169978163 
OR361195 
AX8291993 
Z6250 
Boronic acid, B-(5-ethoxy-2-formylphenyl)- 
C9H11BO4 
Literature
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