BVG

1H-IMIDAZOL-2-YLMETHANOL

Created: 2005-11-08
Last modified:  2011-06-04

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Chemical Details

Formal Charge0
Atom Count13
Chiral Atom Count0
Bond Count13
Aromatic Bond Count5
2D diagram of BVG

Chemical Component Summary

Name1H-IMIDAZOL-2-YLMETHANOL
Systematic Name (OpenEye OEToolkits)1H-imidazol-2-ylmethanol
FormulaC4 H6 N2 O
Molecular Weight98.103
TypeNON-POLYMER

Chemical Descriptors

TypeProgram Version Descriptor
SMILESACDLabs10.04OCc1nccn1
SMILESCACTVS3.341OCc1[nH]ccn1
SMILESOpenEye OEToolkits1.5.0c1cnc([nH]1)CO
Canonical SMILESCACTVS3.341 OCc1[nH]ccn1
Canonical SMILESOpenEye OEToolkits1.5.0 c1cnc([nH]1)CO
InChIInChI1.03 InChI=1S/C4H6N2O/c7-3-4-5-1-2-6-4/h1-2,7H,3H2,(H,5,6)
InChIKeyInChI1.03 ZOMATQMEHRJKLO-UHFFFAOYSA-N

Related Resource References

Resource NameReference
PubChem 566830