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Home Boronic acids 2-[(2-Isopropyl-5-methylphenoxy)methyl]phenylboronic acid

2-[(2-Isopropyl-5-methylphenoxy)methyl]phenylboronic acid

CAS No.:
1072951-87-1
Catalog Number:
AG003G7P
Molecular Formula:
C17H21BO3
Molecular Weight:
284.1578
Pack Size
Purity
Availability
Location
Price(USD)
Quantity
  
1g
98%
In Stock USA
United States
$47
- +
5g
98%
In Stock USA
United States
$200
- +
Product Description
Catalog Number:
AG003G7P
Chemical Name:
2-[(2-Isopropyl-5-methylphenoxy)methyl]phenylboronic acid
CAS Number:
1072951-87-1
Molecular Formula:
C17H21BO3
Molecular Weight:
284.1578
MDL Number:
MFCD08276821
IUPAC Name:
[2-[(5-methyl-2-propan-2-ylphenoxy)methyl]phenyl]boronic acid
InChI:
InChI=1S/C17H21BO3/c1-12(2)15-9-8-13(3)10-17(15)21-11-14-6-4-5-7-16(14)18(19)20/h4-10,12,19-20H,11H2,1-3H3
InChI Key:
JDYAGWNUTBEZCI-UHFFFAOYSA-N
SMILES:
Cc1ccc(c(c1)OCc1ccccc1B(O)O)C(C)C
Properties
Complexity:
308  
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1  
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
284.158g/mol
Formal Charge:
0
Heavy Atom Count:
21  
Hydrogen Bond Acceptor Count:
3  
Hydrogen Bond Donor Count:
2  
Isotope Atom Count:
0
Molecular Weight:
284.162g/mol
Monoisotopic Mass:
284.158g/mol
Rotatable Bond Count:
5  
Topological Polar Surface Area:
49.7A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
Properties