Home Boronic Acids 1072951-59-7
1072951-59-7,MFCD08457647
Catalog No.:AA003IKQ
1072951-59-7 | 3,5-Diiodo-2-methoxyphenylboronic acid
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250mg
97%
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$29.00   $20.00
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1g
97%
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$50.00   $35.00
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Technical Information
Catalog Number:
AA003IKQ
Chemical Name:
3,5-Diiodo-2-methoxyphenylboronic acid
CAS Number:
1072951-59-7
Molecular Formula:
C7H7BI2O3
Molecular Weight:
403.7486
MDL Number:
MFCD08457647
IUPAC Name:
(3,5-diiodo-2-methoxyphenyl)boronic acid
InChI:
InChI=1S/C7H7BI2O3/c1-13-7-5(8(11)12)2-4(9)3-6(7)10/h2-3,11-12H,1H3
InChI Key:
GLXUCKYNVDXHBW-UHFFFAOYSA-N
SMILES:
COc1c(I)cc(cc1B(O)O)I
Properties
Computed Properties
 
Complexity:
170  
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1  
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
403.858g/mol
Formal Charge:
0
Heavy Atom Count:
13  
Hydrogen Bond Acceptor Count:
3  
Hydrogen Bond Donor Count:
2  
Isotope Atom Count:
0
Molecular Weight:
403.749g/mol
Monoisotopic Mass:
403.858g/mol
Rotatable Bond Count:
2  
Topological Polar Surface Area:
49.7A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0

Synonyms
 
3,5-Diiodo-2-methoxyphenylboronic acid 
1072951-59-7 
ZINC169903627 
FCH1388939 
RTR-001622 
AX8281788 
TR-001622 
Z7071 
I04-2887 
(3,5-Diiodo-2-methoxyphenyl)boronic acid 
C7H7BI2O3 
ACMC-2098t6 
CTK4A5293 
DTXSID80584797 
ANW-15688 
MFCD08457647 
AKOS015853785 
Literature
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