3N8
Summary
Name: | 4-fluorobenzene-1,2-diol |
Formula: | C6 H5 F O2 |
Formal charge: | 0 |
Formula weight: | 128.101 Da |
Component type: | NON-POLYMER |
Chemical Identifiers
Program | Version | Name |
ACDLabs | 12.01 | 4-fluorobenzene-1,2-diol |
OpenEye OEToolkits | 1.9.2 | 4-fluoranylbenzene-1,2-diol |
Chemical Descriptors
Type | Program | Version | Descriptor |
SMILES | ACDLabs | 12.01 | Fc1cc(O)c(O)cc1 |
InChI | InChI | 1.03 | InChI=1S/C6H5FO2/c7-4-1-2-5(8)6(9)3-4/h1-3,8-9H |
InChIKey | InChI | 1.03 | NFWGQJUHSAGJBE-UHFFFAOYSA-N |
SMILES_CANONICAL | CACTVS | 3.385 | Oc1ccc(F)cc1O |
SMILES | CACTVS | 3.385 | Oc1ccc(F)cc1O |
SMILES_CANONICAL | OpenEye OEToolkits | 1.9.2 | c1cc(c(cc1F)O)O |
SMILES | OpenEye OEToolkits | 1.9.2 | c1cc(c(cc1F)O)O |