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Home Boronic acids 2-Isopropoxy-5-(trifluoromethyl)pyridine-3-boronic acid

2-Isopropoxy-5-(trifluoromethyl)pyridine-3-boronic acid

CAS No.:
1218790-67-0
Catalog Number:
AG00169D
Molecular Formula:
C9H11BF3NO3
Molecular Weight:
248.9947
Pack Size
Purity
Availability
Location
Price(USD)
Quantity
  
1g
96%
In Stock USA
United States
$88
- +
5g
96%
In Stock USA
United States
$350
- +
10g
96%
In Stock USA
United States
$563
- +
25g
96%
In Stock USA
United States
$1000
- +
Product Description
Catalog Number:
AG00169D
Chemical Name:
2-Isopropoxy-5-(trifluoromethyl)pyridine-3-boronic acid
CAS Number:
1218790-67-0
Molecular Formula:
C9H11BF3NO3
Molecular Weight:
248.9947
MDL Number:
MFCD15143471
IUPAC Name:
[2-propan-2-yloxy-5-(trifluoromethyl)pyridin-3-yl]boronic acid
InChI:
InChI=1S/C9H11BF3NO3/c1-5(2)17-8-7(10(15)16)3-6(4-14-8)9(11,12)13/h3-5,15-16H,1-2H3
InChI Key:
AJWYDUFNUDIURV-UHFFFAOYSA-N
SMILES:
CC(Oc1ncc(cc1B(O)O)C(F)(F)F)C
Properties
Complexity:
250  
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1  
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
249.078g/mol
Formal Charge:
0
Heavy Atom Count:
17  
Hydrogen Bond Acceptor Count:
7  
Hydrogen Bond Donor Count:
2  
Isotope Atom Count:
0
Molecular Weight:
248.996g/mol
Monoisotopic Mass:
249.078g/mol
Rotatable Bond Count:
3  
Topological Polar Surface Area:
62.6A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
Properties