27M
Summary
Name: | bis(2,4-dihydroxyphenyl)methanone |
Formula: | C13 H10 O5 |
Formal charge: | 0 |
Formula weight: | 246.215 Da |
Component type: | NON-POLYMER |
Chemical Identifiers
Program | Version | Name |
ACDLabs | 12.01 | bis(2,4-dihydroxyphenyl)methanone |
OpenEye OEToolkits | 1.7.6 | bis[2,4-bis(oxidanyl)phenyl]methanone |
Chemical Descriptors
Type | Program | Version | Descriptor |
SMILES | ACDLabs | 12.01 | O=C(c1ccc(O)cc1O)c2ccc(O)cc2O |
InChI | InChI | 1.03 | InChI=1S/C13H10O5/c14-7-1-3-9(11(16)5-7)13(18)10-4-2-8(15)6-12(10)17/h1-6,14-17H |
InChIKey | InChI | 1.03 | WXNRYSGJLQFHBR-UHFFFAOYSA-N |
SMILES_CANONICAL | CACTVS | 3.385 | Oc1ccc(c(O)c1)C(=O)c2ccc(O)cc2O |
SMILES | CACTVS | 3.385 | Oc1ccc(c(O)c1)C(=O)c2ccc(O)cc2O |
SMILES_CANONICAL | OpenEye OEToolkits | 1.7.6 | c1cc(c(cc1O)O)C(=O)c2ccc(cc2O)O |
SMILES | OpenEye OEToolkits | 1.7.6 | c1cc(c(cc1O)O)C(=O)c2ccc(cc2O)O |