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1286724-30-8

1286724-30-8 | 6-(o-tolyl)pyridazine-3-thiol

CAS No: 1286724-30-8 Catalog No: AG018BLX MDL No:

Product Description

Catalog Number:
AG018BLX
Chemical Name:
6-(o-tolyl)pyridazine-3-thiol
CAS Number:
1286724-30-8
Molecular Formula:
C11H10N2S
Molecular Weight:
202.2755
IUPAC Name:
3-(2-methylphenyl)-1H-pyridazine-6-thione
InChI:
InChI=1S/C11H10N2S/c1-8-4-2-3-5-9(8)10-6-7-11(14)13-12-10/h2-7H,1H3,(H,13,14)
InChI Key:
JTLUYKMESALWEN-UHFFFAOYSA-N
SMILES:
Sc1ccc(nn1)c1ccccc1C

Properties

Complexity:
294  
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1  
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
202.056g/mol
Formal Charge:
0
Heavy Atom Count:
14  
Hydrogen Bond Acceptor Count:
2  
Hydrogen Bond Donor Count:
1  
Isotope Atom Count:
0
Molecular Weight:
202.275g/mol
Monoisotopic Mass:
202.056g/mol
Rotatable Bond Count:
1  
Topological Polar Surface Area:
56.5A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
2.2  

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