Ethyl 4-hydroxyphenylacetate
PubChem CID: 28310
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| Compound Synonyms | Ethyl 4-hydroxyphenylacetate, 17138-28-2, ethyl 2-(4-hydroxyphenyl)acetate, Benzeneacetic acid, 4-hydroxy-, ethyl ester, 4-Hydroxyphenylacetic acid ethyl ester, ethyl (4-hydroxyphenyl)acetate, Ethyl (p-hydroxyphenyl)acetate, 94NWB742CW, EINECS 241-197-5, MFCD00016491, DTXSID0066165, Acetic acid, (p-hydroxyphenyl)-, ethyl ester, ETHYL-4-HYDROXYPHENYLACETATE, (4-Hydroxy-phenyl)-acetic acid ethylester, Ethyl p-hydroxyphenylacetate, P-Hydroxyphenyl Acetic Acid Ethyl Ester, UNII-94NWB742CW, ethyl (4hydroxyphenyl)acetate, SCHEMBL1179218, DTXCID2035487, AKOS000280327, Ethyl 2-(4-hydroxyphenyl)acetic acid, CS-W017199, FE23013, HY-W016483, 4-hydroxy-phenylacetic acid ethyl ester, 4-hydroxyphenyl acetic acid ethyl ester, AS-10794, SY015387, (4-hydroxy-phenyl)-acetic acid ethyl ester, DB-023047, E1034, NS00025628, EN300-49188, Q67879878, F0001-0623, 241-197-5, 4-Hydroxyphenylacetic acid ethyl ester, 4-Hydroxybenzeneacetic acid ethyl ester, (p-Hydroxyphenyl)acetic acid ethyl ester |
|---|---|
| Topological Polar Surface Area | 46.5 |
| Hydrogen Bond Donor Count | 1.0 |
| Heavy Atom Count | 13.0 |
| Isotope Atom Count | 0.0 |
| Molecular Complexity | 160.0 |
| Database Name | cmaup_ingredients;pubchem |
| Defined Atom Stereocenter Count | 0.0 |
| Iupac Name | ethyl 2-(4-hydroxyphenyl)acetate |
| Prediction Hob | 1.0 |
| Xlogp | 1.9 |
| Molecular Formula | C10H12O3 |
| Prediction Swissadme | 1.0 |
| Inchi Key | HYUPPKVFCGIMDB-UHFFFAOYSA-N |
| Fcsp3 | 0.3 |
| Logs | -1.418 |
| Rotatable Bond Count | 4.0 |
| Logd | 1.764 |
| Compound Name | Ethyl 4-hydroxyphenylacetate |
| Prediction Hob Swissadme | 1.0 |
| Exact Mass | 180.079 |
| Formal Charge | 0.0 |
| Monoisotopic Mass | 180.079 |
| Hydrogen Bond Acceptor Count | 3.0 |
| Molecular Weight | 180.2 |
| Covalent Unit Count | 1.0 |
| Total Atom Stereocenter Count | 0.0 |
| Total Bond Stereocenter Count | 0.0 |
| Esol | -2.2443970615384616 |
| Inchi | InChI=1S/C10H12O3/c1-2-13-10(12)7-8-3-5-9(11)6-4-8/h3-6,11H,2,7H2,1H3 |
| Smiles | CCOC(=O)CC1=CC=C(C=C1)O |
| Nring | 1.0 |
| Defined Bond Stereocenter Count | 0.0 |
- 1. Outgoing r'ship
FOUND_INto/from Agathosma Scaberula (Plant) Rel Props:Source_db:cmaup_ingredients - 2. Outgoing r'ship
FOUND_INto/from Balanophora Harlandii (Plant) Rel Props:Source_db:cmaup_ingredients - 3. Outgoing r'ship
FOUND_INto/from Cichorium Intybus (Plant) Rel Props:Source_db:cmaup_ingredients - 4. Outgoing r'ship
FOUND_INto/from Euphorbia Biglandulosa (Plant) Rel Props:Source_db:cmaup_ingredients - 5. Outgoing r'ship
FOUND_INto/from Lupinus Cosentinii (Plant) Rel Props:Source_db:cmaup_ingredients - 6. Outgoing r'ship
FOUND_INto/from Polemonium Caeruleum (Plant) Rel Props:Source_db:cmaup_ingredients - 7. Outgoing r'ship
FOUND_INto/from Strychnos Ledermannii (Plant) Rel Props:Source_db:cmaup_ingredients - 8. Outgoing r'ship
FOUND_INto/from Taraxacum Mongolicum (Plant) Rel Props:Source_db:cmaup_ingredients - 9. Outgoing r'ship
FOUND_INto/from Taraxacum Obovatum (Plant) Rel Props:Source_db:cmaup_ingredients - 10. Outgoing r'ship
FOUND_INto/from Viburnum Davidii (Plant) Rel Props:Source_db:cmaup_ingredients