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113708-15-9

113708-15-9 | 3(2H)-Pyridazinone, 5-(ethylsulfonyl)-2-methyl-

CAS No: 113708-15-9 Catalog No: AG0009F8 MDL No:

Product Description

Catalog Number:
AG0009F8
Chemical Name:
3(2H)-Pyridazinone, 5-(ethylsulfonyl)-2-methyl-
CAS Number:
113708-15-9
Molecular Formula:
C7H10N2O3S
Molecular Weight:
202.2309
IUPAC Name:
5-ethylsulfonyl-2-methylpyridazin-3-one
InChI:
InChI=1S/C7H10N2O3S/c1-3-13(11,12)6-4-7(10)9(2)8-5-6/h4-5H,3H2,1-2H3
InChI Key:
VYWDBOCQSMXKAY-UHFFFAOYSA-N
SMILES:
CCS(=O)(=O)c1cnn(c(=O)c1)C

Properties

Complexity:
375  
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1  
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
202.041g/mol
Formal Charge:
0
Heavy Atom Count:
13  
Hydrogen Bond Acceptor Count:
4  
Hydrogen Bond Donor Count:
0
Isotope Atom Count:
0
Molecular Weight:
202.228g/mol
Monoisotopic Mass:
202.041g/mol
Rotatable Bond Count:
2  
Topological Polar Surface Area:
75.2A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
-0.7  

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