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Home Boronic acids 4-Benzyloxy-2-dimethylamino-pyrimidine-5-boronic acid

4-Benzyloxy-2-dimethylamino-pyrimidine-5-boronic acid

CAS No.:
205672-21-5
Catalog Number:
AG002AA2
Molecular Formula:
C13H16BN3O3
Molecular Weight:
273.0954
Pack Size
Purity
Availability
Location
Price(USD)
Quantity
  
1g
95%
In Stock USA
United States
$110
- +
5g
95%
In Stock USA
United States
$498
- +
Product Description
Catalog Number:
AG002AA2
Chemical Name:
4-Benzyloxy-2-dimethylamino-pyrimidine-5-boronic acid
CAS Number:
205672-21-5
Molecular Formula:
C13H16BN3O3
Molecular Weight:
273.0954
MDL Number:
MFCD08689616
IUPAC Name:
[2-(dimethylamino)-4-phenylmethoxypyrimidin-5-yl]boronic acid
InChI:
InChI=1S/C13H16BN3O3/c1-17(2)13-15-8-11(14(18)19)12(16-13)20-9-10-6-4-3-5-7-10/h3-8,18-19H,9H2,1-2H3
InChI Key:
WYIPFXDOPGYMLS-UHFFFAOYSA-N
SMILES:
OB(c1cnc(nc1OCc1ccccc1)N(C)C)O
Properties
Complexity:
288  
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1  
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
273.128g/mol
Formal Charge:
0
Heavy Atom Count:
20  
Hydrogen Bond Acceptor Count:
6  
Hydrogen Bond Donor Count:
2  
Isotope Atom Count:
0
Molecular Weight:
273.099g/mol
Monoisotopic Mass:
273.128g/mol
Rotatable Bond Count:
5  
Topological Polar Surface Area:
78.7A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
Properties