Chemical ID: 6321145

CCOC(=O)n1c(cc(n1)C)C
Chemical ID:
6321145
Name [?]:
ethyl 3,5-dimethylpyrazole-1-carboxylate
SMILES [?]:
CCOC(=O)n1c(cc(n1)C)C
InChi [?]:
None
InChi Info:
None

Chemical Details

Atom Count
Formula:C8H12N2O2
All Atoms:12
Heavy Atoms:12
Chiral Atoms:0
ZAP Information [?]
Total:6.628
Area:346.007
Solvation:-2.02218
Coulombic:-26.9128
Bond Count [?]
All:12
Single:9
Double:3
Rotors:3
Chiral:0
Rigid Segments:3
Chemical Properties
Molecular Weight:168.193
H-Bond Donors:0
H-Bond Acceptors:2
XLogP:1.33
LogP (Chemaxon):1.05

Name Annotations

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Experimental Annotations

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Descriptor Annotations

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