Chemical ID: 4763776

CCOC(=O)c1c([nH]c(=O)[nH]1)C
Chemical ID:
4763776
Name [?]:
ethyl 5-methyl-2-oxo-1,3-dihydroimidazole-4-carboxylate
SMILES [?]:
CCOC(=O)c1c([nH]c(=O)[nH]1)C
InChi [?]:
InChI=1/C7H10N2O3/c1-3-12-6(10)5-4(2)8-7(11)9-5/h3H2,1-2H3,(H2,8,9,11)
InChi Info:
AuxInfo=1/1/N:1,12,2,7,6,4,9,8,11,5,10,3/rA:12nCCOCOCCNCONC/rB:s1;s2;s3;d4;s4;d6;s7;s8;d9;s6s9;s7;/rC:;;;;;;;;;;;;

Chemical Details

Atom Count
Formula:C7H10N2O3
All Atoms:12
Heavy Atoms:12
Chiral Atoms:0
ZAP Information [?]
Total:6.48786
Area:338.11
Solvation:-1.9649
Coulombic:-53.1093
Bond Count [?]
All:12
Single:9
Double:3
Rotors:3
Chiral:0
Rigid Segments:3
Chemical Properties
Molecular Weight:170.166
H-Bond Donors:0
H-Bond Acceptors:3
XLogP:0.02
LogP (Chemaxon):-0.07

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