4-(3,5-Dimethoxyphenyl)phenol
PubChem CID: 46879743
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| Compound Synonyms | 4-(3,5-DIMETHOXYPHENYL)PHENOL, 495416-58-5, 3',5'-Dimethoxy[1,1'-biphenyl]-4-ol, MFCD18312923, CHEMBL1080659, SCHEMBL21296879, DTXSID10677000, AKOS017557269, 4-(3,5-Dimethoxyphenyl)phenol, 95%, DB-394487 |
|---|---|
| Topological Polar Surface Area | 38.7 |
| Hydrogen Bond Donor Count | 1.0 |
| Heavy Atom Count | 17.0 |
| Isotope Atom Count | 0.0 |
| Molecular Complexity | 212.0 |
| Database Name | cmaup_ingredients;npass_chem_all;pubchem |
| Defined Atom Stereocenter Count | 0.0 |
| Iupac Name | 4-(3,5-dimethoxyphenyl)phenol |
| Prediction Hob | 1.0 |
| Xlogp | 3.1 |
| Molecular Formula | C14H14O3 |
| Prediction Swissadme | 0.0 |
| Inchi Key | XVRLLKKLNLKAHR-UHFFFAOYSA-N |
| Fcsp3 | 0.1428571428571428 |
| Logs | -4.075 |
| Rotatable Bond Count | 3.0 |
| Logd | 3.426 |
| Compound Name | 4-(3,5-Dimethoxyphenyl)phenol |
| Prediction Hob Swissadme | 0.0 |
| Exact Mass | 230.094 |
| Formal Charge | 0.0 |
| Monoisotopic Mass | 230.094 |
| Hydrogen Bond Acceptor Count | 3.0 |
| Molecular Weight | 230.26 |
| Covalent Unit Count | 1.0 |
| Total Atom Stereocenter Count | 0.0 |
| Total Bond Stereocenter Count | 0.0 |
| Esol | -3.5701835411764713 |
| Inchi | InChI=1S/C14H14O3/c1-16-13-7-11(8-14(9-13)17-2)10-3-5-12(15)6-4-10/h3-9,15H,1-2H3 |
| Smiles | COC1=CC(=CC(=C1)C2=CC=C(C=C2)O)OC |
| Nring | 2.0 |
| Defined Bond Stereocenter Count | 0.0 |
- 1. Outgoing r'ship
FOUND_INto/from Berberis Koreana (Plant) Rel Props:Source_db:cmaup_ingredients;npass_chem_all