Home Other Building Blocks 5-BROMO-2-METHOXY-4-(METHYLTHIO)PYRIMIDINE

5-BROMO-2-METHOXY-4-(METHYLTHIO)PYRIMIDINE

CAS No.:
59549-52-9
Catalog Number:
AG00EDA0
Molecular Formula:
C6H7BrN2OS
Molecular Weight:
235.1016
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Product Description
Catalog Number:
AG00EDA0
Chemical Name:
5-BROMO-2-METHOXY-4-(METHYLTHIO)PYRIMIDINE
CAS Number:
59549-52-9
Molecular Formula:
C6H7BrN2OS
Molecular Weight:
235.1016
MDL Number:
MFCD07781219
IUPAC Name:
5-bromo-2-methoxy-4-methylsulfanylpyrimidine
InChI:
InChI=1S/C6H7BrN2OS/c1-10-6-8-3-4(7)5(9-6)11-2/h3H,1-2H3
InChI Key:
RUALHKGODQGZFN-UHFFFAOYSA-N
SMILES:
COc1ncc(c(n1)SC)Br
Properties
Complexity:
127  
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1  
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
233.946g/mol
Formal Charge:
0
Heavy Atom Count:
11  
Hydrogen Bond Acceptor Count:
4  
Hydrogen Bond Donor Count:
0
Isotope Atom Count:
0
Molecular Weight:
235.099g/mol
Monoisotopic Mass:
233.946g/mol
Rotatable Bond Count:
2  
Topological Polar Surface Area:
60.3A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
2  
Properties