4-Propenylphenol, (E)-
PubChem CID: 5474441
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| Compound Synonyms | trans-anol, trans-Isochavicol, 20649-39-2, isochavicol, 4-Propenylphenol, (E)-, t-anol, 4-[(1E)-prop-1-en-1-yl]phenol, trans-4-Propenylphenol, (E)-4-(1-Propenyl)phenol, Phenol, p-propenyl-, (E)-, 4-[(E)-prop-1-enyl]phenol, Phenol, 4-(1E)-1-propenyl-, FEMA No. 4062, E-, Phenol, 4-(1-propenyl)-, (E)-, E-anol, 4-hydroxy-1-propenylbenzene, 4-Propenyl-phenol, 20748P37VF, UNII-20748P37VF, (E)-4-Propenylphenol, CHEMBL163297, CHEBI:73343, (E)-1-(4-hydroxyphenyl)propene, DTXSID50174684, 4-((1E)-prop-1-en-1-yl)phenol, panol, trans-p-Anol, (E)-4-Hydroxypropenylbenzene, SCHEMBL555296, DTXCID9097175, UMFCIIBZHQXRCJ-NSCUHMNNSA-N, BDBM50017832, NS00125722, C20464, EN300-7441166, Q27140446, 843-931-5 |
|---|---|
| Topological Polar Surface Area | 20.2 |
| Hydrogen Bond Donor Count | 1.0 |
| Heavy Atom Count | 10.0 |
| Isotope Atom Count | 0.0 |
| Molecular Complexity | 110.0 |
| Database Name | cmaup_ingredients;npass_chem_all;pubchem |
| Defined Atom Stereocenter Count | 0.0 |
| Uniprot Id | P15101 |
| Iupac Name | 4-[(E)-prop-1-enyl]phenol |
| Prediction Hob | 1.0 |
| Xlogp | 2.6 |
| Molecular Formula | C9H10O |
| Prediction Swissadme | 0.0 |
| Inchi Key | UMFCIIBZHQXRCJ-NSCUHMNNSA-N |
| Fcsp3 | 0.1111111111111111 |
| Logs | -1.926 |
| Rotatable Bond Count | 1.0 |
| Logd | 2.831 |
| Compound Name | 4-Propenylphenol, (E)- |
| Prediction Hob Swissadme | 0.0 |
| Exact Mass | 134.073 |
| Formal Charge | 0.0 |
| Monoisotopic Mass | 134.073 |
| Hydrogen Bond Acceptor Count | 1.0 |
| Molecular Weight | 134.17 |
| Covalent Unit Count | 1.0 |
| Total Atom Stereocenter Count | 0.0 |
| Total Bond Stereocenter Count | 1.0 |
| Esol | -2.6753036 |
| Inchi | InChI=1S/C9H10O/c1-2-3-8-4-6-9(10)7-5-8/h2-7,10H,1H3/b3-2+ |
| Smiles | C/C=C/C1=CC=C(C=C1)O |
| Nring | 1.0 |
| Defined Bond Stereocenter Count | 1.0 |
- 1. Outgoing r'ship
FOUND_INto/from Cirsium Chinense (Plant) Rel Props:Source_db:cmaup_ingredients;npass_chem_all