94N
Summary
Name: | 2,6-bis(bromanyl)phenol |
Formula: | C6 H4 Br2 O |
Formal charge: | 0 |
Formula weight: | 251.903 Da |
Component type: | NON-POLYMER |
Chemical Identifiers
Program | Version | Name |
OpenEye OEToolkits | 2.0.6 | 2,6-bis(bromanyl)phenol |
Chemical Descriptors
Type | Program | Version | Descriptor |
InChI | InChI | 1.03 | InChI=1S/C6H4Br2O/c7-4-2-1-3-5(8)6(4)9/h1-3,9H |
InChIKey | InChI | 1.03 | SSIZLKDLDKIHEV-UHFFFAOYSA-N |
SMILES_CANONICAL | CACTVS | 3.385 | Oc1c(Br)cccc1Br |
SMILES | CACTVS | 3.385 | Oc1c(Br)cccc1Br |
SMILES_CANONICAL | OpenEye OEToolkits | 2.0.6 | c1cc(c(c(c1)Br)O)Br |
SMILES | OpenEye OEToolkits | 2.0.6 | c1cc(c(c(c1)Br)O)Br |