Chemical ID: 4561412

c1ccc2c(c1)c(cc(=O)[nH]2)O
Chemical ID:
4561412
Name [?]:
4-hydroxy-1H-quinolin-2-one
SMILES [?]:
c1ccc2c(c1)c(cc(=O)[nH]2)O
InChi [?]:
InChI=1/C9H7NO2/c11-8-5-9(12)10-7-4-2-1-3-6(7)8/h1-5H,(H2,10,11,12)
InChi Info:
AuxInfo=1/1/N:1,2,6,3,8,5,4,7,9,11,12,10/rA:12nCCCCCCCCCONO/rB:s1;d2;s3;d4;d1s5;s5;d7;s8;d9;s4s9;s7;/rC:;;;;;;;;;;;;

Chemical Details

Atom Count
Formula:C9H7NO2
All Atoms:12
Heavy Atoms:12
Chiral Atoms:0
ZAP Information [?]
Total:5.37035
Area:307.36
Solvation:-2.31365
Coulombic:-36.9277
Bond Count [?]
All:13
Single:8
Double:5
Rotors:0
Chiral:0
Rigid Segments:1
Chemical Properties
Molecular Weight:161.157
H-Bond Donors:1
H-Bond Acceptors:2
XLogP:1.16
LogP (Chemaxon):1.65

Name Annotations

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Experimental Annotations

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Descriptor Annotations

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