Paroxypropione
PubChem CID: 6271
Connections displayed (default: 10).
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| Compound Synonyms | 4'-Hydroxypropiophenone, 70-70-2, Paroxypropione, 4-Hydroxypropiophenone, 1-(4-hydroxyphenyl)propan-1-one, p-Hydroxypropiophenone, Mepal, Paroxypropion, Frenantol, Frenohypon, Profenone, Proxiphenon, Paroxon, p-Propiophenol, p-Propionylphenol, 1-Propanone, 1-(4-hydroxyphenyl)-, Hypophenon, Possipione, Sterofenon, Frenormon, Hypostat, Ibiopopp, Frenon, Bio-fren, 4-Propionylphenol, p-Oxypropiophenone, Paraoxypropiophenone, Paroxipropiona, 1-(4-Hydroxyphenyl)-1-propanone, Usaf ek-3302, Parossipropione, Paroxypropionum, Possipion, p-Hydroxyphenyl-1-propanone, Ethyl p-hydroxyphenyl ketone, Parossipropione [DCIT], B-360, H 365, H-365, 1-(p-Hydroxyphenyl)-1-propanone, Paroxypropione [INN:DCF], Propiophenone, 4'-hydroxy-, Paroxypropionum [INN-Latin], Paroxipropiona [INN-Spanish], 1-(4-Hydroxy-phenyl)-propan-1-one, 4-Propanoylphenol, NSC 2834, NSC-2834, B 360, EINECS 200-743-2, BRN 0907511, 4-Hydroxypropiophenon, P.O.P., DTXSID8023426, Paroxypropione (INN), UNII-X9952001TG, AI3-03719, MFCD00002361, PAROXYPROPIONE [MI], X9952001TG, PAROXYPROPIONE [INN], p-Hydroxypropiophenone (JAN), MLS000069406, PAROXYPROPIONE [MART.], CHEMBL312311, DTXCID103426, PAROXYPROPIONE [WHO-DD], CHEBI:32352, NSC2834, 4-08-00-00441 (Beilstein Handbook Reference), P-HYDROXYPROPIOPHENONE [JAN], NCGC00018097-04, NCGC00018097-06, SMR000059092, WLN: QR DV2, Paroxypropionum (INN-Latin), Paroxipropiona (INN-Spanish), PAROXYPROPIONE (MART.), CAS-70-70-2, para-Hydroxypropiophenone, p-Hydroxypropiophenon, VANATONE, 4-hydroxy propiophenone, 4`-Hydroxypropiophenone, 4'-hydroxy-propiophenone, 4''-Hydroxypropiophenone, Opera_ID_1001, Ethyl 4-Hydroxyphenyl Ketone, SCHEMBL440470, 4?-HYDROXYPROPIOPHENONE, 4'-Hydroxypropiophenone, 98%, F1995-0235, HMS2235G15, HMS3264A14, HMS3372E08, Pharmakon1600-01506169, 1-(4-hydroxyphenyl)-propan-1-one, BCP26379, HY-B1353, NSC33949, Tox21_110822, AC7855, BBL011845, BDBM50177402, NSC-33949, NSC760386, s5396, STK397478, AKOS000120374, Tox21_110822_1, CCG-214030, CS-7973, FH71324, NSC-760386, NCGC00018097-01, NCGC00018097-02, NCGC00018097-03, NCGC00018097-05, NCGC00022475-03, NCGC00022475-04, AC-10985, AS-12055, DA-59760, SY003666, H0299, NS00003309, EN300-21481, D01870, SBI-0653508.0001, 4 inverted exclamation mark -Hydroxypropiophenone, 4 inverted exclamation marka-Hydroxypropiophenone, AB00384258_14, AF-676/00077028, SR-01000002967, SR-01000002967-2, BRD-K07441213-001-14-8, BRD-K07441213-001-18-9, Q19598411, Z104499156, 200-743-2 |
|---|---|
| Topological Polar Surface Area | 37.3 |
| Hydrogen Bond Donor Count | 1.0 |
| Heavy Atom Count | 11.0 |
| Isotope Atom Count | 0.0 |
| Molecular Complexity | 134.0 |
| Database Name | cmaup_ingredients;npass_chem_all;pubchem |
| Defined Atom Stereocenter Count | 0.0 |
| Uniprot Id | P19785, P51649, P80404, P37058, Q962Y6, Q194T2, n.a., P83916, P25094, O75496, O75874, O95398, P27695, P0DTD1, Q16236 |
| Iupac Name | 1-(4-hydroxyphenyl)propan-1-one |
| Prediction Hob | 1.0 |
| Target Id | NPT675, NPT674, NPT958 |
| Xlogp | 2.0 |
| Molecular Formula | C9H10O2 |
| Prediction Swissadme | 0.0 |
| Inchi Key | RARSHUDCJQSEFJ-UHFFFAOYSA-N |
| Fcsp3 | 0.2222222222222222 |
| Logs | -2.002 |
| Rotatable Bond Count | 2.0 |
| Logd | 1.707 |
| Compound Name | Paroxypropione |
| Prediction Hob Swissadme | 0.0 |
| Exact Mass | 150.068 |
| Formal Charge | 0.0 |
| Monoisotopic Mass | 150.068 |
| Hydrogen Bond Acceptor Count | 2.0 |
| Molecular Weight | 150.17 |
| Covalent Unit Count | 1.0 |
| Total Atom Stereocenter Count | 0.0 |
| Total Bond Stereocenter Count | 0.0 |
| Esol | -2.3216337636363638 |
| Inchi | InChI=1S/C9H10O2/c1-2-9(11)7-3-5-8(10)6-4-7/h3-6,10H,2H2,1H3 |
| Smiles | CCC(=O)C1=CC=C(C=C1)O |
| Nring | 1.0 |
| Defined Bond Stereocenter Count | 0.0 |
- 1. Outgoing r'ship
FOUND_INto/from Acacia Salicina (Plant) Rel Props:Source_db:cmaup_ingredients;npass_chem_all - 2. Outgoing r'ship
FOUND_INto/from Achillea Wilhelmsii (Plant) Rel Props:Source_db:cmaup_ingredients;npass_chem_all - 3. Outgoing r'ship
FOUND_INto/from Backhousia Angustifolia (Plant) Rel Props:Source_db:cmaup_ingredients;npass_chem_all - 4. Outgoing r'ship
FOUND_INto/from Blighia Welwitschii (Plant) Rel Props:Source_db:cmaup_ingredients;npass_chem_all - 5. Outgoing r'ship
FOUND_INto/from Cunninghamia Lanceolata (Plant) Rel Props:Source_db:cmaup_ingredients;npass_chem_all - 6. Outgoing r'ship
FOUND_INto/from Dioscorea Villosa (Plant) Rel Props:Source_db:cmaup_ingredients;npass_chem_all - 7. Outgoing r'ship
FOUND_INto/from Juniperus Ashei (Plant) Rel Props:Source_db:cmaup_ingredients;npass_chem_all - 8. Outgoing r'ship
FOUND_INto/from Kalanchoe Blossfeldiana (Plant) Rel Props:Source_db:cmaup_ingredients;npass_chem_all - 9. Outgoing r'ship
FOUND_INto/from Sassafras Officinalis (Plant) Rel Props:Source_db:cmaup_ingredients;npass_chem_all - 10. Outgoing r'ship
FOUND_INto/from Tanacetum Nubigenum (Plant) Rel Props:Source_db:cmaup_ingredients;npass_chem_all