Chemical ID: 5166971

CS(=O)(=O)c1cccnn1
Chemical ID:
5166971
Name [?]:
3-methylsulfonylpyridazine
SMILES [?]:
CS(=O)(=O)c1cccnn1
InChi [?]:
InChI=1/C5H6N2O2S/c1-10(8,9)5-3-2-4-6-7-5/h2-4H,1H3
InChi Info:
AuxInfo=1/0/N:1,7,6,8,5,9,10,3,4,2/E:(8,9)/CRV:10.6/rA:10nCSOOCCCCNN/rB:s1;d2;d2;s2;s5;d6;s7;d8;d5s9;/rC:;;;;;;;;;;

Chemical Details

Atom Count
Formula:C5H6N2O2S
All Atoms:10
Heavy Atoms:10
Chiral Atoms:0
ZAP Information [?]
Total:4.23994
Area:295.721
Solvation:-3.15309
Coulombic:-5.47918
Bond Count [?]
All:10
Single:5
Double:5
Rotors:1
Chiral:0
Rigid Segments:2
Chemical Properties
Molecular Weight:158.179
H-Bond Donors:0
H-Bond Acceptors:2
XLogP:-0.45
LogP (Chemaxon):-1.13

Name Annotations

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Experimental Annotations

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Descriptor Annotations

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