Cas no 39604-67-6 (Ethanone, 1-(2-hydroxy-4,6-dimethoxy-3-methylphenyl)-2-phenyl-)
39604-67-6 structure
Product Name:Ethanone, 1-(2-hydroxy-4,6-dimethoxy-3-methylphenyl)-2-phenyl-
CAS No:39604-67-6
MF:C17H18O4
MW:286.322425365448
CID:1509850
PubChem ID:85807354
Update Time:2025-04-21
Ethanone, 1-(2-hydroxy-4,6-dimethoxy-3-methylphenyl)-2-phenyl- Chemical and Physical Properties
Names and Identifiers
-
- Ethanone, 1-(2-hydroxy-4,6-dimethoxy-3-methylphenyl)-2-phenyl-
- 39604-67-6
- 1-(2-hydroxy-4,6-dimethoxy-3-methylphenyl)-2-phenylethanone
- DTXSID401187445
-
- Inchi： 1S/C17H18O4/c1-11-14(20-2)10-15(21-3)16(17(11)19)13(18)9-12-7-5-4-6-8-12/h4-8,10,19H,9H2,1-3H3
- InChI Key： ACLCKGICFMORIO-UHFFFAOYSA-N
- SMILES： O(C)C1C=C(C(C)=C(C=1C(CC1C=CC=CC=1)=O)O)OC
Computed Properties
- Exact Mass: 286.12054
- Monoisotopic Mass: 286.12050905g/mol
- Isotope Atom Count: 0
- Hydrogen Bond Donor Count: 1
- Hydrogen Bond Acceptor Count: 4
- Heavy Atom Count: 21
- Rotatable Bond Count: 5
- Complexity: 338
- Covalently-Bonded Unit Count: 1
- Defined Atom Stereocenter Count: 0
- Undefined Atom Stereocenter Count : 0
- Defined Bond Stereocenter Count: 0
- Undefined Bond Stereocenter Count: 0
- XLogP3: 3.7
- Topological Polar Surface Area: 55.8?2
Experimental Properties
- PSA: 55.76
Ethanone, 1-(2-hydroxy-4,6-dimethoxy-3-methylphenyl)-2-phenyl- Related Literature
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Min Kim,Jae-Joon Lee,Tengling Ye,Panagiotis E. Keivanidis,Kilwon Cho J. Mater. Chem. C, 2020,8, 1686-1696
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Denis V. Korchagin,Elena A. Yureva,Alexander V. Akimov,Eugenii Ya. Misochko,Gennady V. Shilov,Artem D. Talantsev,Roman B. Morgunov,Alexander A. Shakin,Sergey M. Aldoshin,Boris S. Tsukerblat Dalton Trans., 2017,46, 7540-7548
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Jing Yu,Yu-Qi Lyu,Jiapeng Liu,Mohammed B. Effat,Junxiong Wu J. Mater. Chem. A, 2019,7, 17995-18002
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Erika A. Cobar,Paul R. Horn,Robert G. Bergman,Martin Head-Gordon Phys. Chem. Chem. Phys., 2012,14, 15328-15339
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J. Matthew Kurley,Phillip W. Halstenberg,Abbey McAlister,Stephen Raiman,Richard T. Mayes RSC Adv., 2019,9, 25602-25608
39604-67-6 (Ethanone, 1-(2-hydroxy-4,6-dimethoxy-3-methylphenyl)-2-phenyl-) Related Products
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