Chemical ID: 7092530

c1c(n[nH]c1C(=O)O)C2CC2
Chemical ID:
7092530
Name [?]:
5-cyclopropyl-2H-pyrazole-3-carboxylic acid
SMILES [?]:
c1c(n[nH]c1C(=O)O)C2CC2
InChi [?]:
InChI=1/C7H8N2O2/c10-7(11)6-3-5(8-9-6)4-1-2-4/h3-4H,1-2H2,(H,8,9)(H,10,11)
InChi Info:
AuxInfo=1/1/N:10,11,1,9,2,5,6,3,4,7,8/E:(1,2)(10,11)/rA:11nCCNNCCOOCCC/rB:s1;d2;s3;d1s4;s5;d6;s6;s2;s9;s9s10;/rC:;;;;;;;;;;;

Chemical Details

Atom Count
Formula:C7H8N2O2
All Atoms:19
Heavy Atoms:11
Chiral Atoms:0
ZAP Information [?]
Total:5.90463
Area:315.544
Solvation:-1.98396
Coulombic:-36.8433
Bond Count [?]
All:12
Single:9
Double:3
Rotors:2
Chiral:0
Rigid Segments:3
Chemical Properties
Molecular Weight:152.151
H-Bond Donors:1
H-Bond Acceptors:2
XLogP:0.77
LogP (Chemaxon):0.37

Name Annotations

Note: All annotations are abbreviated. For more detailed information please download chemical.

ChemicalMix SourceExternal IDDescriptorValue

Experimental Annotations

Note: All annotations are abbreviated. For more detailed information please download chemical.

Chemical MixSourceExternal IDDescriptorValue

Descriptor Annotations

Note: All annotations are abbreviated. For more detailed information please download chemical.

Chemical MixSourceExternal IDDescriptorValue