2,4-Bis(4-hydroxybenzyl)phenol
PubChem CID: 193195
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| Compound Synonyms | 2,4-Bis(4-hydroxybenzyl)phenol, 34826-64-7, 2,4-bis[(4-hydroxyphenyl)methyl]phenol, 2,4-Bis(4-hydroxybenzyl) phenol, JZ8542V589, Bis(hobz)phenol, Phenol, 2,4-bis((4-hydroxyphenyl)methyl)-, 2,4-BIS((4-HYDROXYPHENYL)METHYL)PHENOL, Compound NP-023297, SCHEMBL8349574, CHEMBL3286745, UNII-JZ8542V589, DTXSID70188364, AKOS040735031, Q4596774, 2,4-XYLENOL, .ALPHA.,.ALPHA.'-BIS(P-HYDROXYPHENYL)- |
|---|---|
| Topological Polar Surface Area | 60.7 |
| Hydrogen Bond Donor Count | 3.0 |
| Heavy Atom Count | 23.0 |
| Isotope Atom Count | 0.0 |
| Molecular Complexity | 343.0 |
| Database Name | cmaup_ingredients;pubchem |
| Defined Atom Stereocenter Count | 0.0 |
| Iupac Name | 2,4-bis[(4-hydroxyphenyl)methyl]phenol |
| Nih Violation | False |
| Prediction Hob | 1.0 |
| Xlogp | 4.7 |
| Is Pains | False |
| Molecular Formula | C20H18O3 |
| Prediction Swissadme | 0.0 |
| Inchi Key | YQOVRUAPWCGSLC-UHFFFAOYSA-N |
| Fcsp3 | 0.1 |
| Rotatable Bond Count | 4.0 |
| Compound Name | 2,4-Bis(4-hydroxybenzyl)phenol |
| Prediction Hob Swissadme | 0.0 |
| Exact Mass | 306.126 |
| Formal Charge | 0.0 |
| Brenk Violation | False |
| Monoisotopic Mass | 306.126 |
| Hydrogen Bond Acceptor Count | 3.0 |
| Molecular Weight | 306.4 |
| Covalent Unit Count | 1.0 |
| Total Atom Stereocenter Count | 0.0 |
| Total Bond Stereocenter Count | 0.0 |
| Esol | -5.015568634782609 |
| Inchi | InChI=1S/C20H18O3/c21-18-6-1-14(2-7-18)11-16-5-10-20(23)17(13-16)12-15-3-8-19(22)9-4-15/h1-10,13,21-23H,11-12H2 |
| Smiles | C1=CC(=CC=C1CC2=CC(=C(C=C2)O)CC3=CC=C(C=C3)O)O |
| Defined Bond Stereocenter Count | 0.0 |
- 1. Outgoing r'ship
FOUND_INto/from Xanthium Strumarium (Plant) Rel Props:Source_db:cmaup_ingredients