Chemical ID: 4165422

Cc1c(c2ccccc2[nH]c1=O)O
Chemical ID:
4165422
Name [?]:
4-hydroxy-3-methyl-1H-quinolin-2-one
SMILES [?]:
Cc1c(c2ccccc2[nH]c1=O)O
InChi [?]:
InChI=1/C10H9NO2/c1-6-9(12)7-4-2-3-5-8(7)11-10(6)13/h2-5H,1H3,(H2,11,12,13)
InChi Info:
AuxInfo=1/1/N:1,6,7,5,8,2,4,9,3,11,10,13,12/rA:13nCCCCCCCCCNCOO/rB:s1;d2;s3;s4;d5;s6;d7;d4s8;s9;s2s10;d11;s3;/rC:;;;;;;;;;;;;;

Chemical Details

Atom Count
Formula:C10H9NO2
All Atoms:13
Heavy Atoms:13
Chiral Atoms:0
ZAP Information [?]
Total:6.08691
Area:325.454
Solvation:-2.04946
Coulombic:-37.5001
Bond Count [?]
All:14
Single:9
Double:5
Rotors:0
Chiral:0
Rigid Segments:1
Chemical Properties
Molecular Weight:175.184
H-Bond Donors:1
H-Bond Acceptors:2
XLogP:1.31
LogP (Chemaxon):2.12

Name Annotations

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Experimental Annotations

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Descriptor Annotations

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