OHG
(2-methyl-1H-imidazol-4-yl)methanol
Created: | 2019-06-25 |
Last modified: | 2019-12-11 |
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Chemical Details | |
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Formal Charge | 0 |
Atom Count | 16 |
Chiral Atom Count | 0 |
Bond Count | 16 |
Aromatic Bond Count | 5 |
Chemical Component Summary | |
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Name | (2-methyl-1H-imidazol-4-yl)methanol |
Systematic Name (OpenEye OEToolkits) | (2-methyl-1~{H}-imidazol-4-yl)methanol |
Formula | C5 H8 N2 O |
Molecular Weight | 112.13 |
Type | NON-POLYMER |
Chemical Descriptors | |||
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Type | Program | Version | Descriptor |
SMILES | ACDLabs | 12.01 | Cc1nc(cn1)CO |
SMILES | CACTVS | 3.385 | Cc1[nH]cc(CO)n1 |
SMILES | OpenEye OEToolkits | 2.0.7 | Cc1[nH]cc(n1)CO |
Canonical SMILES | CACTVS | 3.385 | Cc1[nH]cc(CO)n1 |
Canonical SMILES | OpenEye OEToolkits | 2.0.7 | Cc1[nH]cc(n1)CO |
InChI | InChI | 1.03 | InChI=1S/C5H8N2O/c1-4-6-2-5(3-8)7-4/h2,8H,3H2,1H3,(H,6,7) |
InChIKey | InChI | 1.03 | MQRMTENGXFRETM-UHFFFAOYSA-N |
Related Resource References
Resource Name | Reference |
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PubChem | 11480420 |