Chemical ID: 5132114

Cc1cc(c(c(c1OC)C)C)c2cc(n[nH]2)C(=O)O
Chemical ID:
5132114
Name [?]:
5-(4-methoxy-2,3,5-trimethyl-phenyl)-1H-pyrazole-3-carboxylic acid
SMILES [?]:
Cc1cc(c(c(c1OC)C)C)c2cc(n[nH]2)C(=O)O
InChi [?]:
None
InChi Info:
None

Chemical Details

Atom Count
Formula:C14H16N2O3
All Atoms:19
Heavy Atoms:19
Chiral Atoms:0
ZAP Information [?]
Total:7.81843
Area:446.171
Solvation:-3.33584
Coulombic:-45.1271
Bond Count [?]
All:20
Single:14
Double:6
Rotors:3
Chiral:0
Rigid Segments:4
Chemical Properties
Molecular Weight:260.289
H-Bond Donors:1
H-Bond Acceptors:3
XLogP:3.08
LogP (Chemaxon):2.89

Name Annotations

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Experimental Annotations

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Descriptor Annotations

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