Home Boronic Acids 1226773-36-9
1226773-36-9,MFCD18383732
Catalog No.:AA0017IX
1226773-36-9 | 5-(Benzyloxy)-2-formylphenylboronic acid
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Purity
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Price(USD)
Quantity
  
1g
96%
in stock  
$250.00   $175.00
- +
5g
96%
in stock  
$1,032.00   $723.00
- +
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Technical Information
Catalog Number:
AA0017IX
Chemical Name:
5-(Benzyloxy)-2-formylphenylboronic acid
CAS Number:
1226773-36-9
Molecular Formula:
C14H13BO4
Molecular Weight:
256.0616
MDL Number:
MFCD18383732
IUPAC Name:
(2-formyl-5-phenylmethoxyphenyl)boronic acid
InChI:
InChI=1S/C14H13BO4/c16-9-12-6-7-13(8-14(12)15(17)18)19-10-11-4-2-1-3-5-11/h1-9,17-18H,10H2
InChI Key:
FEFDHTIODOFOKS-UHFFFAOYSA-N
SMILES:
O=Cc1ccc(cc1B(O)O)OCc1ccccc1
Properties
Computed Properties
 
Complexity:
279  
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1  
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
256.091g/mol
Formal Charge:
0
Heavy Atom Count:
19  
Hydrogen Bond Acceptor Count:
4  
Hydrogen Bond Donor Count:
2  
Isotope Atom Count:
0
Molecular Weight:
256.064g/mol
Monoisotopic Mass:
256.091g/mol
Rotatable Bond Count:
5  
Topological Polar Surface Area:
66.8A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0

Synonyms
 
1226773-36-9 
(5-(Benzyloxy)-2-formylphenyl)boronic acid 
OR360686 
AX8283930 
TC-106756 
Z8630 
Boronic acid, B-[2-formyl-5-(phenylmethoxy)phenyl]- 
C14H13BO4 
5-(Benzyloxy)-2-formylphenylboronic acid 
[5-(Benzyloxy)-2-formylphenyl]boronic acid 
ACMC-209alp 
CTK8A9518 
DTXSID50742680 
ANW-18011 
AKOS024258181 
ZINC169978272 
Literature
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