Home Boronic Acids 845551-45-3
845551-45-3,MFCD05865198
Catalog No.:AA003HXQ
845551-45-3 | 3-(2'-Chlorobenzyloxy)phenylboronic acid
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250mg
98%
in stock  
$23.00   $16.00
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1g
98%
in stock  
$46.00   $32.00
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Technical Information
Catalog Number:
AA003HXQ
Chemical Name:
3-(2'-Chlorobenzyloxy)phenylboronic acid
CAS Number:
845551-45-3
Molecular Formula:
C13H12BClO3
Molecular Weight:
262.4966
MDL Number:
MFCD05865198
IUPAC Name:
[3-[(2-chlorophenyl)methoxy]phenyl]boronic acid
InChI:
InChI=1S/C13H12BClO3/c15-13-7-2-1-4-10(13)9-18-12-6-3-5-11(8-12)14(16)17/h1-8,16-17H,9H2
InChI Key:
XHGOCNFADOJUMW-UHFFFAOYSA-N
SMILES:
Clc1ccccc1COc1cccc(c1)B(O)O
Properties
Computed Properties
 
Complexity:
252  
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1  
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
262.057g/mol
Formal Charge:
0
Heavy Atom Count:
18  
Hydrogen Bond Acceptor Count:
3  
Hydrogen Bond Donor Count:
2  
Isotope Atom Count:
0
Molecular Weight:
262.496g/mol
Monoisotopic Mass:
262.057g/mol
Rotatable Bond Count:
4  
Topological Polar Surface Area:
49.7A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0

Synonyms
 
845551-45-3 
3-(2'-Chlorobenzyloxy)phenylboronic acid 
AKOS009319816 
ZINC169877120 
AB22959 
RTR-026140 
AS-55261 
BP-11442 
OR360905 
AX8280845 
X2298 
I01-16377 
(3-((2-Chlorobenzyl)oxy)phenyl)boronic acid 
3-(2 inverted exclamation marka-Chlorobenzyloxy)phenylboronic acid 
3- phenylboronicacid 
C13H12BClO3 
3-(2-Chlorobenzyloxy)phenylboronic acid 
{3-[(2-Chlorophenyl)methoxy]phenyl}boronic acid 
SCHEMBL21763 
CTK8B2395 
DTXSID30584505 
ANW-37807 
MFCD05865198 
Literature
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