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Chemical ID: 6497533
Chemical ID:
6497533
Name [?]:
4-hydroxy-1,6-dimethyl-quinolin-2-one
SMILES [?]:
Cc1ccc2c(c1)c(cc(=O)n2C)O
InChi [?]:
InChI=1/C11H11NO2/c1-7-3-4-9-8(5-7)10(13)6-11(14)12(9)2/h3-6,13H,1-2H3
InChi Info:
AuxInfo=1/0/N:1,13,3,4,7,9,2,6,5,8,10,12,14,11/rA:14nCCCCCCCCCCONCO/rB:s1;s2;d3;s4;d5;d2s6;s6;d8;s9;d10;s5s10;s12;s8;/rC:;;;;;;;;;;;;;;
Chemical Details
Atom Count
Formula: | C11H11NO2 |
All Atoms: | 14 |
Heavy Atoms: | 14 |
Chiral Atoms: | 0 |
ZAP Information [?]
Total: | 6.24163 |
Area: | 344.81 |
Solvation: | -2.37862 |
Coulombic: | -32.3297 |
Bond Count [?]
All: | 15 |
Single: | 10 |
Double: | 5 |
Rotors: | 0 |
Chiral: | 0 |
Rigid Segments: | 1 |
Chemical Properties
Molecular Weight: | 189.211 |
H-Bond Donors: | 1 |
H-Bond Acceptors: | 2 |
XLogP: | 1.74 |
LogP (Chemaxon): | 2.37 |
Name Annotations
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Experimental Annotations
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Descriptor Annotations
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