Cas no 55338-29-9 (Ethanone, 1-(2,4-dihydroxy-6-methylphenyl)-2-phenyl-)
55338-29-9 structure
Product Name:Ethanone, 1-(2,4-dihydroxy-6-methylphenyl)-2-phenyl-
CAS No:55338-29-9
MF:C15H14O3
MW:242.269864559174
CID:4034770
PubChem ID:902176
Update Time:2025-04-22
Ethanone, 1-(2,4-dihydroxy-6-methylphenyl)-2-phenyl- Chemical and Physical Properties
Names and Identifiers
-
- Ethanone, 1-(2,4-dihydroxy-6-methylphenyl)-2-phenyl-
- 1-(2,4-Dihydroxy-6-methylphenyl)-2-phenylethanone
- AK-087/42718410
- 55338-29-9
- SCHEMBL11566548
- CHEMBL1376126
- HMS2548H14
- MLS000705585
- SMR000231084
-
- Inchi： 1S/C15H14O3/c1-10-7-12(16)9-14(18)15(10)13(17)8-11-5-3-2-4-6-11/h2-7,9,16,18H,8H2,1H3
- InChI Key： IYGIJUCMIPDPFQ-UHFFFAOYSA-N
- SMILES： OC1=CC(=CC(C)=C1C(CC1C=CC=CC=1)=O)O
Computed Properties
- Exact Mass: 242.094294304g/mol
- Monoisotopic Mass: 242.094294304g/mol
- Isotope Atom Count: 0
- Hydrogen Bond Donor Count: 2
- Hydrogen Bond Acceptor Count: 3
- Heavy Atom Count: 18
- Rotatable Bond Count: 3
- Complexity: 284
- 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: 3.4
- Topological Polar Surface Area: 57.5?2
Ethanone, 1-(2,4-dihydroxy-6-methylphenyl)-2-phenyl- Related Literature
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Xiaotong Feng,Lei Bian,Jie Ma,Lei Zhou,Xiayan Wang,Guangsheng Guo,Qiaosheng Pu Chem. Commun., 2019,55, 3963-3966
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Joo Chuan Yeo,Kenry Lab Chip, 2016,16, 4082-4090
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Dhirendra K. Chaudhary,Pramendra Kumar,Lokendra Kumar RSC Adv., 2016,6, 94731-94738
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Amandine Altmayer-Henzien,Valérie Declerck,David J. Aitken,Ewen Lescop,Denis Merlet,Jonathan Farjon Org. Biomol. Chem., 2013,11, 7611-7615
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Max Attwood,Hiroki Akutsu,Lee Martin,Toby J. Blundell,Pierre Le Maguere,Scott S. Turner Dalton Trans., 2021,50, 11843-11851
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