Home Carboxys 6-(tert-Butyl)-2-hydroxypyrimidine-4-carboxylic acid

6-(tert-Butyl)-2-hydroxypyrimidine-4-carboxylic acid

CAS No.:
1000353-37-6
Catalog Number:
AG00J2L1
Molecular Formula:
C9H15ClN2O4
Molecular Weight:
250.6794
Pack Size
Purity
Availability
Location
Price(USD)
Quantity
  
1g
95%
In Stock USA
United States
$168
- +
5g
95%
In Stock USA
United States
$444
- +
Product Description
Catalog Number:
AG00J2L1
Chemical Name:
6-(tert-Butyl)-2-hydroxypyrimidine-4-carboxylic acid
CAS Number:
1000353-37-6
Molecular Formula:
C9H15ClN2O4
Molecular Weight:
250.6794
MDL Number:
MFCD11049200
IUPAC Name:
6-tert-butyl-2-oxo-1H-pyrimidine-4-carboxylic acid
InChI:
InChI=1S/C9H12N2O3/c1-9(2,3)6-4-5(7(12)13)10-8(14)11-6/h4H,1-3H3,(H,12,13)(H,10,11,14)
InChI Key:
VJBOARHIJSWQLY-UHFFFAOYSA-N
SMILES:
Oc1nc(cc(n1)C(C)(C)C)C(=O)O.O.Cl
Properties
Complexity:
348  
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1  
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
196.085g/mol
Formal Charge:
0
Heavy Atom Count:
14  
Hydrogen Bond Acceptor Count:
3  
Hydrogen Bond Donor Count:
2  
Isotope Atom Count:
0
Molecular Weight:
196.206g/mol
Monoisotopic Mass:
196.085g/mol
Rotatable Bond Count:
2  
Topological Polar Surface Area:
78.8A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
0.9  
Properties