8RU
Summary
Name: | 4-ethylbenzene-1,2-diol |
Formula: | C8 H10 O2 |
Formal charge: | 0 |
Formula weight: | 138.164 Da |
Component type: | non-polymer |
Chemical Identifiers
Program | Version | Name |
OpenEye OEToolkits | 2.0.7 | 4-ethylbenzene-1,2-diol |
Chemical Descriptors
Type | Program | Version | Descriptor |
InChI | InChI | 1.06 | InChI=1S/C8H10O2/c1-2-6-3-4-7(9)8(10)5-6/h3-5,9-10H,2H2,1H3 |
InChIKey | InChI | 1.06 | HFLGBNBLMBSXEM-UHFFFAOYSA-N |
SMILES_CANONICAL | CACTVS | 3.385 | CCc1ccc(O)c(O)c1 |
SMILES | CACTVS | 3.385 | CCc1ccc(O)c(O)c1 |
SMILES_CANONICAL | OpenEye OEToolkits | 2.0.7 | CCc1ccc(c(c1)O)O |
SMILES | OpenEye OEToolkits | 2.0.7 | CCc1ccc(c(c1)O)O |