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Home Boronic acids [4-Chloro-2-methyl-5-(pyridin-3-ylmethoxy)phenyl]boronic acid

[4-Chloro-2-methyl-5-(pyridin-3-ylmethoxy)phenyl]boronic acid

CAS No.:
2096339-48-7
Catalog Number:
AG01EHGB
Molecular Formula:
C13H13BClNO3
Molecular Weight:
277.5112
Pack Size
Purity
Availability
Location
Price(USD)
Quantity
  
250mg
95%
In Stock USA
United States
$150
- +
1g
95%
In Stock USA
United States
$350
- +
5g
95%
In Stock USA
United States
$1050
- +
Product Description
Catalog Number:
AG01EHGB
Chemical Name:
[4-Chloro-2-methyl-5-(pyridin-3-ylmethoxy)phenyl]boronic acid
CAS Number:
2096339-48-7
Molecular Formula:
C13H13BClNO3
Molecular Weight:
277.5112
MDL Number:
MFCD20441813
IUPAC Name:
[4-chloro-2-methyl-5-(pyridin-3-ylmethoxy)phenyl]boronic acid
InChI:
InChI=1S/C13H13BClNO3/c1-9-5-12(15)13(6-11(9)14(17)18)19-8-10-3-2-4-16-7-10/h2-7,17-18H,8H2,1H3
InChI Key:
SYNHYQFOXOBFFB-UHFFFAOYSA-N
SMILES:
Clc1cc(C)c(cc1OCc1cccnc1)B(O)O
Properties
Complexity:
283  
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1  
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
277.068g/mol
Formal Charge:
0
Heavy Atom Count:
19  
Hydrogen Bond Acceptor Count:
4  
Hydrogen Bond Donor Count:
2  
Isotope Atom Count:
0
Molecular Weight:
277.511g/mol
Monoisotopic Mass:
277.068g/mol
Rotatable Bond Count:
4  
Topological Polar Surface Area:
62.6A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
Properties