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Home Boronic acids 3-[(4-Chloro-3-methylphenoxy)methyl]phenylboronic acid

3-[(4-Chloro-3-methylphenoxy)methyl]phenylboronic acid

CAS No.:
1072951-91-7
Catalog Number:
AG003IRF
Molecular Formula:
C14H14BClO3
Molecular Weight:
276.5232
Pack Size
Purity
Availability
Location
Price(USD)
Quantity
  
1g
95%
In Stock USA
United States
$32
- +
5g
95%
In Stock USA
United States
$125
- +
Product Description
Catalog Number:
AG003IRF
Chemical Name:
3-[(4-Chloro-3-methylphenoxy)methyl]phenylboronic acid
CAS Number:
1072951-91-7
Molecular Formula:
C14H14BClO3
Molecular Weight:
276.5232
MDL Number:
MFCD09265140
IUPAC Name:
[3-[(4-chloro-3-methylphenoxy)methyl]phenyl]boronic acid
InChI:
InChI=1S/C14H14BClO3/c1-10-7-13(5-6-14(10)16)19-9-11-3-2-4-12(8-11)15(17)18/h2-8,17-18H,9H2,1H3
InChI Key:
MLTCJWUQGYLPLF-UHFFFAOYSA-N
SMILES:
OB(c1cccc(c1)COc1ccc(c(c1)C)Cl)O
Properties
Complexity:
277  
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1  
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
276.072g/mol
Formal Charge:
0
Heavy Atom Count:
19  
Hydrogen Bond Acceptor Count:
3  
Hydrogen Bond Donor Count:
2  
Isotope Atom Count:
0
Molecular Weight:
276.523g/mol
Monoisotopic Mass:
276.072g/mol
Rotatable Bond Count:
4  
Topological Polar Surface Area:
49.7A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
Properties