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14001-63-9

14001-63-9 | Pyrimidine, 4-methyl-2-(methylthio)-

CAS No: 14001-63-9 Catalog No: AG001BXU MDL No:MFCD00023242

Product Description

Catalog Number:
AG001BXU
Chemical Name:
Pyrimidine, 4-methyl-2-(methylthio)-
CAS Number:
14001-63-9
Molecular Formula:
C6H8N2S
Molecular Weight:
140.2061
MDL Number:
MFCD00023242
IUPAC Name:
4-methyl-2-methylsulfanylpyrimidine
InChI:
InChI=1S/C6H8N2S/c1-5-3-4-7-6(8-5)9-2/h3-4H,1-2H3
InChI Key:
UCERVHYBSTYCQS-UHFFFAOYSA-N
SMILES:
CSc1nccc(n1)C

Properties

Complexity:
87.1  
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1  
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
140.041g/mol
Formal Charge:
0
Heavy Atom Count:
9  
Hydrogen Bond Acceptor Count:
3  
Hydrogen Bond Donor Count:
0
Isotope Atom Count:
0
Molecular Weight:
140.204g/mol
Monoisotopic Mass:
140.041g/mol
Rotatable Bond Count:
1  
Topological Polar Surface Area:
51.1A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
1.4  

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