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Methyl 2-amino-4-p-tolylpyrimidine-5-carboxylate

CAS No.:
1133115-58-8
Catalog Number:
AG003RMO
Molecular Formula:
C13H13N3O2
Molecular Weight:
243.2612
Pack Size
Purity
Availability
Location
Price(USD)
Quantity
  
1g
97%
In Stock USA
United States
$50
- +
5g
97%
In Stock USA
United States
$150
- +
25g
97%
In Stock USA
United States
$450
- +
Product Description
Catalog Number:
AG003RMO
Chemical Name:
Methyl 2-amino-4-p-tolylpyrimidine-5-carboxylate
CAS Number:
1133115-58-8
Molecular Formula:
C13H13N3O2
Molecular Weight:
243.2612
MDL Number:
MFCD11855875
IUPAC Name:
methyl 2-amino-4-(4-methylphenyl)pyrimidine-5-carboxylate
InChI:
InChI=1S/C13H13N3O2/c1-8-3-5-9(6-4-8)11-10(12(17)18-2)7-15-13(14)16-11/h3-7H,1-2H3,(H2,14,15,16)
InChI Key:
RURVMBMZJVLGHL-UHFFFAOYSA-N
SMILES:
COC(=O)c1cnc(nc1c1ccc(cc1)C)N
Properties
Complexity:
290  
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1  
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
243.101g/mol
Formal Charge:
0
Heavy Atom Count:
18  
Hydrogen Bond Acceptor Count:
5  
Hydrogen Bond Donor Count:
1  
Isotope Atom Count:
0
Molecular Weight:
243.266g/mol
Monoisotopic Mass:
243.101g/mol
Rotatable Bond Count:
3  
Topological Polar Surface Area:
78.1A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
1.7  
Properties