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1243388-92-2

1243388-92-2 | 2-(methylsulfanyl)pyridin-4-ol

CAS No: 1243388-92-2 Catalog No: AG01EMCM MDL No:MFCD16999076

Product Description

Catalog Number:
AG01EMCM
Chemical Name:
2-(methylsulfanyl)pyridin-4-ol
CAS Number:
1243388-92-2
Molecular Formula:
C6H7NOS
Molecular Weight:
141.1909
MDL Number:
MFCD16999076
IUPAC Name:
2-methylsulfanyl-1H-pyridin-4-one
InChI:
InChI=1S/C6H7NOS/c1-9-6-4-5(8)2-3-7-6/h2-4H,1H3,(H,7,8)
InChI Key:
UDOJBJDWMCKREP-UHFFFAOYSA-N
SMILES:
CSc1cc(O)ccn1

Properties

Complexity:
184  
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1  
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
141.025g/mol
Formal Charge:
0
Heavy Atom Count:
9  
Hydrogen Bond Acceptor Count:
3  
Hydrogen Bond Donor Count:
1  
Isotope Atom Count:
0
Molecular Weight:
141.188g/mol
Monoisotopic Mass:
141.025g/mol
Rotatable Bond Count:
1  
Topological Polar Surface Area:
54.4A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
0.9  

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