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Chemical ID: 4734705
Chemical ID:
4734705
Name [?]:
N-(2-hydroxy-5-methyl-phenyl)acetamide
SMILES [?]:
Cc1ccc(c(c1)NC(=O)C)O
InChi [?]:
InChI=1/C9H11NO2/c1-6-3-4-9(12)8(5-6)10-7(2)11/h3-5,12H,1-2H3,(H,10,11)
InChi Info:
AuxInfo=1/1/N:1,11,3,4,7,2,9,6,5,8,10,12/rA:12nCCCCCCCNCOCO/rB:s1;s2;d3;s4;d5;d2s6;s6;s8;d9;s9;s5;/rC:;;;;;;;;;;;;
Chemical Details
Atom Count
Formula: | C9H11NO2 |
All Atoms: | 12 |
Heavy Atoms: | 12 |
Chiral Atoms: | 0 |
ZAP Information [?]
Total: | 5.90784 |
Area: | 330.573 |
Solvation: | -2.35648 |
Coulombic: | -35.9759 |
Bond Count [?]
All: | 12 |
Single: | 8 |
Double: | 4 |
Rotors: | 2 |
Chiral: | 0 |
Rigid Segments: | 2 |
Chemical Properties
Molecular Weight: | 165.189 |
H-Bond Donors: | 2 |
H-Bond Acceptors: | 3 |
XLogP: | 1.74 |
LogP (Chemaxon): | 1.55 |
Name Annotations
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Experimental Annotations
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Descriptor Annotations
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