Chemical ID: 4166947

c1ccc(cc1)c2c(cc(=O)[nH]n2)O
Chemical ID:
4166947
Name [?]:
5-hydroxy-6-phenyl-2H-pyridazin-3-one
SMILES [?]:
c1ccc(cc1)c2c(cc(=O)[nH]n2)O
InChi [?]:
InChI=1/C10H8N2O2/c13-8-6-9(14)11-12-10(8)7-4-2-1-3-5-7/h1-6H,(H2,11,13,14)
InChi Info:
AuxInfo=1/1/N:1,2,6,3,5,9,4,8,10,7,12,13,14,11/E:(2,3)(4,5)/rA:14nCCCCCCCCCCONNO/rB:s1;d2;s3;d4;d1s5;s4;s7;d8;s9;d10;s10;d7s12;s8;/rC:;;;;;;;;;;;;;;

Chemical Details

Atom Count
Formula:C10H8N2O2
All Atoms:14
Heavy Atoms:14
Chiral Atoms:0
ZAP Information [?]
Total:6.01778
Area:343.757
Solvation:-2.57614
Coulombic:-36.847
Bond Count [?]
All:15
Single:9
Double:6
Rotors:1
Chiral:0
Rigid Segments:2
Chemical Properties
Molecular Weight:188.183
H-Bond Donors:1
H-Bond Acceptors:2
XLogP:2.08
LogP (Chemaxon):1.66

Name Annotations

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Experimental Annotations

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Descriptor Annotations

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