Home Boronic Acids 1007170-24-2
1007170-24-2,MFCD08701723
Catalog No.:AA0002MN
1007170-24-2 | 3-Benzyloxy-4-chlorophenylboronic acid
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1g
98%
in stock  
$215.00   $150.00
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5g
98%
in stock  
$715.00   $500.00
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10g
98%
in stock  
$1,191.00   $834.00
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Technical Information
Catalog Number:
AA0002MN
Chemical Name:
3-Benzyloxy-4-chlorophenylboronic acid
CAS Number:
1007170-24-2
Molecular Formula:
C13H12BClO3
Molecular Weight:
262.4966
MDL Number:
MFCD08701723
IUPAC Name:
(4-chloro-3-phenylmethoxyphenyl)boronic acid
InChI:
InChI=1S/C13H12BClO3/c15-12-7-6-11(14(16)17)8-13(12)18-9-10-4-2-1-3-5-10/h1-8,16-17H,9H2
InChI Key:
ZTFFXVLPGHNNKQ-UHFFFAOYSA-N
SMILES:
OB(c1ccc(c(c1)OCc1ccccc1)Cl)O
Properties
Computed Properties
 
Complexity:
246  
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
 
1007170-24-2 
3-BENZYLOXY-4-CHLOROPHENYLBORONIC ACID 
MFCD08701723 
AKOS004113773 
ZINC169844707 
AB48430 
FCH2820636 
3-benzyloxy-4-chlorophenyl boronic acid 
3-(benzyloxy)-4-chlorophenylboronic acid 
OR360681 
AX8235992 
TR-033784 
(3-(Benzyloxy)-4-chlorophenyl)boronic acid 
CS-0091602 
FT-0738659 
X1485 
A-4079 
I04-2172 
Boronic acid, B-[4-chloro-3-(phenylmethoxy)phenyl]- 
C13H12BClO3 
[3-(benzyloxy)-4-chlorophenyl]boronic acid 
SCHEMBL544428 
ACMC-2097s1 
CTK3J9190 
DTXSID30629647 
ZTFFXVLPGHNNKQ-UHFFFAOYSA-N 
ANW-14351 
Literature
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