UVY
Summary
Name: | 2-(1-ethyl-1H-pyrazol-4-yl)ethan-1-ol |
Formula: | C7 H12 N2 O |
Formal charge: | 0 |
Formula weight: | 140.183 Da |
Component type: | non-polymer |
Chemical Identifiers
Program | Version | Name |
ACDLabs | 12.01 | 2-(1-ethyl-1H-pyrazol-4-yl)ethan-1-ol |
OpenEye OEToolkits | 2.0.7 | 2-(1-ethylpyrazol-4-yl)ethanol |
Chemical Descriptors
Type | Program | Version | Descriptor |
SMILES | ACDLabs | 12.01 | n1cc(CCO)cn1CC |
InChI | InChI | 1.03 | InChI=1S/C7H12N2O/c1-2-9-6-7(3-4-10)5-8-9/h5-6,10H,2-4H2,1H3 |
InChIKey | InChI | 1.03 | GQXSHPZGPIOSHQ-UHFFFAOYSA-N |
SMILES_CANONICAL | CACTVS | 3.385 | CCn1cc(CCO)cn1 |
SMILES | CACTVS | 3.385 | CCn1cc(CCO)cn1 |
SMILES_CANONICAL | OpenEye OEToolkits | 2.0.7 | CCn1cc(cn1)CCO |
SMILES | OpenEye OEToolkits | 2.0.7 | CCn1cc(cn1)CCO |