Cas no 918896-70-5 (1-Butanone, 1-(2,4-dihydroxy-6-methoxy-3-methylphenyl)-2-methyl-)
918896-70-5 structure
Product Name:1-Butanone, 1-(2,4-dihydroxy-6-methoxy-3-methylphenyl)-2-methyl-
CAS No:918896-70-5
MF:C13H18O4
MW:238.279624462128
CID:768936
PubChem ID:16094889
Update Time:2025-04-19
1-Butanone, 1-(2,4-dihydroxy-6-methoxy-3-methylphenyl)-2-methyl- Chemical and Physical Properties
Names and Identifiers
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- 1-Butanone, 1-(2,4-dihydroxy-6-methoxy-3-methylphenyl)-2-methyl-
- 1-(2,4-dihydroxy-6-methoxy-3-methylphenyl)-2-methylbutan-1-one
- SCHEMBL3174244
- 918896-70-5
- DTXSID00582472
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- Inchi： 1S/C13H18O4/c1-5-7(2)12(15)11-10(17-4)6-9(14)8(3)13(11)16/h6-7,14,16H,5H2,1-4H3
- InChI Key： FDTJSHFNUMGUHU-UHFFFAOYSA-N
- SMILES： O=C(C1C(=CC(=C(C)C=1O)O)OC)C(C)CC
Computed Properties
- Exact Mass: 238.12050905g/mol
- Monoisotopic Mass: 238.12050905g/mol
- Isotope Atom Count: 0
- Hydrogen Bond Donor Count: 2
- Hydrogen Bond Acceptor Count: 4
- Heavy Atom Count: 17
- Rotatable Bond Count: 4
- Complexity: 266
- Covalently-Bonded Unit Count: 1
- Defined Atom Stereocenter Count: 0
- Undefined Atom Stereocenter Count : 1
- Defined Bond Stereocenter Count: 0
- Undefined Bond Stereocenter Count: 0
- XLogP3: 3.2
- Topological Polar Surface Area: 66.8?2
1-Butanone, 1-(2,4-dihydroxy-6-methoxy-3-methylphenyl)-2-methyl- Related Literature
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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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Qiao Song,Angela Bamesberger,Lingyun Yang,Haley Houtwed,Haishi Cao Analyst, 2014,139, 3588-3592
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3. Fe3O4/Au/Fe3O4 nanoflowers exhibiting tunable saturation magnetization and enhanced bioconjugationFeng Shi,Kunping Yan,Mingli Peng,Xiao Cheng,Yanling Luo,Xuemei Chen,V. A. L. Roy,Zuankai Wang Nanoscale, 2012,4, 747-751
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Sowmyalakshmi Venkataraman RSC Adv., 2015,5, 73807-73813
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Tao Wang,Yangyang Liu,Yue Deng,Hongbo Fu,Jianmin Chen Environ. Sci.: Nano, 2018,5, 1821-1833
918896-70-5 (1-Butanone, 1-(2,4-dihydroxy-6-methoxy-3-methylphenyl)-2-methyl-) Related Products
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