DUB
Summary
Name: | 2,6-dichlorophenol |
Formula: | C6 H4 Cl2 O |
Formal charge: | 0 |
Formula weight: | 163.001 Da |
Component type: | NON-POLYMER |
Chemical Identifiers
Program | Version | Name |
OpenEye OEToolkits | 2.0.6 | 2,6-bis(chloranyl)phenol |
Chemical Descriptors
Type | Program | Version | Descriptor |
InChI | InChI | 1.03 | InChI=1S/C6H4Cl2O/c7-4-2-1-3-5(8)6(4)9/h1-3,9H |
InChIKey | InChI | 1.03 | HOLHYSJJBXSLMV-UHFFFAOYSA-N |
SMILES_CANONICAL | CACTVS | 3.385 | Oc1c(Cl)cccc1Cl |
SMILES | CACTVS | 3.385 | Oc1c(Cl)cccc1Cl |
SMILES_CANONICAL | OpenEye OEToolkits | 2.0.6 | c1cc(c(c(c1)Cl)O)Cl |
SMILES | OpenEye OEToolkits | 2.0.6 | c1cc(c(c(c1)Cl)O)Cl |