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Home > Pyridines > 637354-24-6
637354-24-6 | 2-METHYLTHIO-4-PYRIDIN-3-YL-PYRIMIDINE
CAS No: 637354-24-6 Catalog No: AG00EJRQ MDL No:MFCD00112799
Product Description
Catalog Number:
AG00EJRQ
Chemical Name:
2-METHYLTHIO-4-PYRIDIN-3-YL-PYRIMIDINE
CAS Number:
637354-24-6
Molecular Formula:
C10H9N3S
Molecular Weight:
203.2636
MDL Number:
MFCD00112799
IUPAC Name:
2-methylsulfanyl-4-pyridin-3-ylpyrimidine
InChI:
InChI=1S/C10H9N3S/c1-14-10-12-6-4-9(13-10)8-3-2-5-11-7-8/h2-7H,1H3
InChI Key:
HSHPKFOQRCFEAO-UHFFFAOYSA-N
SMILES:
CSc1nccc(n1)c1cccnc1
Properties
Complexity:
177
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
203.052g/mol
Formal Charge:
0
Heavy Atom Count:
14
Hydrogen Bond Acceptor Count:
4
Hydrogen Bond Donor Count:
0
Isotope Atom Count:
0
Molecular Weight:
203.263g/mol
Monoisotopic Mass:
203.052g/mol
Rotatable Bond Count:
2
Topological Polar Surface Area:
64A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
1.6
Literature
| Title | Journal |
|---|---|
| 2-Methyl-sulfanyl-4-(3-pyrid-yl)pyrimidine. | Acta crystallographica. Section E, Structure reports online 20091001 |
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