Home Carboxys Methyl 2-(methylthio)pyrimidine-5-carboxylate

Methyl 2-(methylthio)pyrimidine-5-carboxylate

CAS No.:
38275-41-1
Catalog Number:
AG00BZJ2
Molecular Formula:
C7H8N2O2S
Molecular Weight:
184.2156
Pack Size
Purity
Availability
Location
Price(USD)
Quantity
  
250mg
95%
In Stock USA
United States
$145
- +
1g
95%
In Stock USA
United States
$404
- +
Product Description
Catalog Number:
AG00BZJ2
Chemical Name:
Methyl 2-(methylthio)pyrimidine-5-carboxylate
CAS Number:
38275-41-1
Molecular Formula:
C7H8N2O2S
Molecular Weight:
184.2156
MDL Number:
MFCD00194932
IUPAC Name:
methyl 2-methylsulfanylpyrimidine-5-carboxylate
InChI:
InChI=1S/C7H8N2O2S/c1-11-6(10)5-3-8-7(12-2)9-4-5/h3-4H,1-2H3
InChI Key:
PSYRMEZGAWNWHV-UHFFFAOYSA-N
SMILES:
COC(=O)c1cnc(nc1)SC
Properties
Complexity:
158  
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1  
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
184.031g/mol
Formal Charge:
0
Heavy Atom Count:
12  
Hydrogen Bond Acceptor Count:
5  
Hydrogen Bond Donor Count:
0
Isotope Atom Count:
0
Molecular Weight:
184.213g/mol
Monoisotopic Mass:
184.031g/mol
Rotatable Bond Count:
3  
Topological Polar Surface Area:
77.4A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
0.9  
Properties