1-Penten-3-one, 4-methyl-1-phenyl-

PubChem CID: 5354448

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Compound Synonyms	Isopropyl styryl ketone, 1-PENTEN-3-ONE, 4-METHYL-1-PHENYL-, 4-Methyl-1-phenyl-1-penten-3-one, 4-Methyl-1-phenylpent-1-en-3-one, 3160-32-5, EINECS 221-606-3, NSC 10750, NSC 651783, BRN 1861618, AI3-21917, NSC651783, 1-07-00-00198 (Beilstein Handbook Reference), NSC-10750, NSC-651783, DTXSID7062877, UPCMLD00WV-108, SCHEMBL2622483, SCHEMBL5231718, YXK7U33A62, CHEMBL1965580, DTXCID4038392, NSC10750, 1-Phenyl-4-methylpent-1-en-3-one, 4-Methyl-3-oxo-1-phenyl-1-pentene, AKOS022953674, (E)-4-Methyl-1-phenyl-1-penten-3-one, trans-2-methyl-5-phenyl-4-penten-3-one, (E)-4-methyl-1-phenyl-pent-1-en-3-one, 4-Methyl-1-phenyl-1-penten-3-one, (E)-, (1E)-4-Methyl-1-phenyl-1-penten-3-one #, 4-METHYL-1-PHENYL-PENT-1-EN-3-ONE, 1-Penten-3-one, 4-methyl-1-phenyl-, (1E)-, 1,3-Pentadien-3-ol, 4-methyl-1-phenyl-, (1E)-, 10596-48-2, 221-606-3
Topological Polar Surface Area	17.1
Hydrogen Bond Donor Count	0.0
Heavy Atom Count	13.0
Isotope Atom Count	0.0
Molecular Complexity	185.0
Database Name	cmaup_ingredients;npass_chem_all;pubchem
Defined Atom Stereocenter Count	0.0
Iupac Name	(E)-4-methyl-1-phenylpent-1-en-3-one
Prediction Hob	1.0
Xlogp	3.1
Molecular Formula	C12H14O
Prediction Swissadme	0.0
Inchi Key	CAXIQKXPSQYDIR-CMDGGOBGSA-N
Fcsp3	0.25
Logs	-3.685
Rotatable Bond Count	3.0
Logd	3.219
Compound Name	1-Penten-3-one, 4-methyl-1-phenyl-
Prediction Hob Swissadme	0.0
Exact Mass	174.104
Formal Charge	0.0
Monoisotopic Mass	174.104
Hydrogen Bond Acceptor Count	1.0
Molecular Weight	174.24
Covalent Unit Count	1.0
Total Atom Stereocenter Count	0.0
Total Bond Stereocenter Count	1.0
Esol	-3.0231450615384614
Inchi	InChI=1S/C12H14O/c1-10(2)12(13)9-8-11-6-4-3-5-7-11/h3-10H,1-2H3/b9-8+
Smiles	CC(C)C(=O)/C=C/C1=CC=CC=C1
Nring	1.0
Defined Bond Stereocenter Count	1.0

1. Outgoing r'ship FOUND_IN to/from Amomum Aromaticum (Plant) Rel Props:Reference:
2. Outgoing r'ship FOUND_IN to/from Chaerophyllum Aromaticum (Plant) Rel Props:Reference:
3. Outgoing r'ship FOUND_IN to/from Cinnamomum Aromaticum (Plant) Rel Props:Reference:
4. Outgoing r'ship FOUND_IN to/from Eugenia Bracteata (Plant) Rel Props:Reference:
5. Outgoing r'ship FOUND_IN to/from Eugenia Caryopyhllata (Plant) Rel Props:Source_db:npass_chem_all
6. Outgoing r'ship FOUND_IN to/from Eugenia Cuspidate (Plant) Rel Props:Reference:
7. Outgoing r'ship FOUND_IN to/from Eugenia Edulis (Plant) Rel Props:Reference:
8. Outgoing r'ship FOUND_IN to/from Eugenia Exsucca (Plant) Rel Props:Reference:
9. Outgoing r'ship FOUND_IN to/from Eugenia Jambolana (Plant) Rel Props:Reference:
10. Outgoing r'ship FOUND_IN to/from Eugenia Myrcianthes (Plant) Rel Props:Reference:
11. Outgoing r'ship FOUND_IN to/from Eugenia Sandwicensis (Plant) Rel Props:Reference:
12. Outgoing r'ship FOUND_IN to/from Eugenia Uniflora (Plant) Rel Props:Reference:
13. Outgoing r'ship FOUND_IN to/from Helenium Aromaticum (Plant) Rel Props:Reference:
14. Outgoing r'ship FOUND_IN to/from Syzygium Alternifolium (Plant) Rel Props:Reference:
15. Outgoing r'ship FOUND_IN to/from Syzygium Aqueum (Plant) Rel Props:Reference:
16. Outgoing r'ship FOUND_IN to/from Syzygium Aromaticum (Plant) Rel Props:Source_db:cmaup_ingredients;npass_chem_all
17. Outgoing r'ship FOUND_IN to/from Syzygium Caryophyllatum (Plant) Rel Props:Reference:
18. Outgoing r'ship FOUND_IN to/from Syzygium Claviflorum (Plant) Rel Props:Reference:
19. Outgoing r'ship FOUND_IN to/from Syzygium Cordatum (Plant) Rel Props:Reference:
20. Outgoing r'ship FOUND_IN to/from Syzygium Cumini (Plant) Rel Props:Reference:
21. Outgoing r'ship FOUND_IN to/from Syzygium Hemisphericum (Plant) Rel Props:Reference:
22. Outgoing r'ship FOUND_IN to/from Syzygium Jambolanum (Plant) Rel Props:Reference:
23. Outgoing r'ship FOUND_IN to/from Syzygium Jambos (Plant) Rel Props:Reference:
24. Outgoing r'ship FOUND_IN to/from Syzygium Levinei (Plant) Rel Props:Reference:
25. Outgoing r'ship FOUND_IN to/from Syzygium Malaccense (Plant) Rel Props:Reference:
26. Outgoing r'ship FOUND_IN to/from Syzygium Nervosum (Plant) Rel Props:Reference:
27. Outgoing r'ship FOUND_IN to/from Syzygium Polycephaloides (Plant) Rel Props:Reference:
28. Outgoing r'ship FOUND_IN to/from Syzygium Praecox (Plant) Rel Props:Reference:
29. Outgoing r'ship FOUND_IN to/from Syzygium Salicifolium (Plant) Rel Props:Reference:
30. Outgoing r'ship FOUND_IN to/from Syzygium Samarangense (Plant) Rel Props:Reference:
31. Outgoing r'ship FOUND_IN to/from Syzygium Travancoricum (Plant) Rel Props:Reference:
32. Outgoing r'ship FOUND_IN to/from Syzygium Zeylanicum (Plant) Rel Props:Reference:
33. Outgoing r'ship FOUND_IN to/from Zingiber Aromaticum (Plant) Rel Props:Reference:

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1-Penten-3-one, 4-methyl-1-phenyl-

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Phytochemical Properties

Associated Connections 33

Plant Connections 33