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84203-61-2 | Pyridine, 2,6-bis[(methylthio)methyl]-
CAS No: 84203-61-2 Catalog No: AG004YI6 MDL No:
Product Description
Catalog Number:
AG004YI6
Chemical Name:
Pyridine, 2,6-bis[(methylthio)methyl]-
CAS Number:
84203-61-2
Molecular Formula:
C9H13NS2
Molecular Weight:
199.3362
IUPAC Name:
2,6-bis(methylsulfanylmethyl)pyridine
InChI:
InChI=1S/C9H13NS2/c1-11-6-8-4-3-5-9(10-8)7-12-2/h3-5H,6-7H2,1-2H3
InChI Key:
RAICPCFODOXJBO-UHFFFAOYSA-N
SMILES:
CSCc1cccc(n1)CSC
Properties
Complexity:
107
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
199.049g/mol
Formal Charge:
0
Heavy Atom Count:
12
Hydrogen Bond Acceptor Count:
3
Hydrogen Bond Donor Count:
0
Isotope Atom Count:
0
Molecular Weight:
199.33g/mol
Monoisotopic Mass:
199.049g/mol
Rotatable Bond Count:
4
Topological Polar Surface Area:
63.5A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
1.8
Literature
| Title | Journal |
|---|---|
| Investigation of group 12 metal complexes with a tridentate SNS ligand by X-ray crystallography and 1H NMR spectroscopy. | Inorganic chemistry 20060123 |
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