Chemical ID: 5757592

CC(=O)n1ccc(n1)C(=O)O
Chemical ID:
5757592
Name [?]:
1-acetylpyrazole-3-carboxylic acid
SMILES [?]:
CC(=O)n1ccc(n1)C(=O)O
InChi [?]:
None
InChi Info:
None

Chemical Details

Atom Count
Formula:C6H6N2O3
All Atoms:11
Heavy Atoms:11
Chiral Atoms:0
ZAP Information [?]
Total:5.24692
Area:312.657
Solvation:-2.5695
Coulombic:-41.18
Bond Count [?]
All:11
Single:7
Double:4
Rotors:2
Chiral:0
Rigid Segments:3
Chemical Properties
Molecular Weight:154.124
H-Bond Donors:1
H-Bond Acceptors:3
XLogP:-0.11
LogP (Chemaxon):-0.19

Name Annotations

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Experimental Annotations

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Descriptor Annotations

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