Home Other Building Blocks 5-Bromo-2,4-bis(methylthio)pyrimidine

5-Bromo-2,4-bis(methylthio)pyrimidine

CAS No.:
60186-81-4
Catalog Number:
AG00EETF
Molecular Formula:
C6H7BrN2S2
Molecular Weight:
251.1672
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Product Description
Catalog Number:
AG00EETF
Chemical Name:
5-Bromo-2,4-bis(methylthio)pyrimidine
CAS Number:
60186-81-4
Molecular Formula:
C6H7BrN2S2
Molecular Weight:
251.1672
MDL Number:
MFCD18975198
IUPAC Name:
5-bromo-2,4-bis(methylsulfanyl)pyrimidine
InChI:
InChI=1S/C6H7BrN2S2/c1-10-5-4(7)3-8-6(9-5)11-2/h3H,1-2H3
InChI Key:
UTPGGEJUFJYLHN-UHFFFAOYSA-N
SMILES:
CSc1ncc(c(n1)SC)Br
NSC Number:
46973
Properties
Complexity:
125  
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1  
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
249.923g/mol
Formal Charge:
0
Heavy Atom Count:
11  
Hydrogen Bond Acceptor Count:
4  
Hydrogen Bond Donor Count:
0
Isotope Atom Count:
0
Molecular Weight:
251.16g/mol
Monoisotopic Mass:
249.923g/mol
Rotatable Bond Count:
2  
Topological Polar Surface Area:
76.4A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
2.6  
Properties