Cas no 89647-61-0 (1-Butanone, 1-(2,6-dihydroxy-4-methoxy-3-methylphenyl)-2-methyl-)
89647-61-0 structure
Product Name:1-Butanone, 1-(2,6-dihydroxy-4-methoxy-3-methylphenyl)-2-methyl-
CAS No:89647-61-0
MF:C13H18O4
MW:238.279624462128
CID:593538
PubChem ID:50908690
Update Time:2025-04-19
1-Butanone, 1-(2,6-dihydroxy-4-methoxy-3-methylphenyl)-2-methyl- Chemical and Physical Properties
Names and Identifiers
-
- 1-Butanone, 1-(2,6-dihydroxy-4-methoxy-3-methylphenyl)-2-methyl-
- 1-(2,6-dihydroxy-4-methoxy-3-methylphenyl)-2-methylbutan-1-one
- DTXSID60678966
- CHEBI:70395
- CHEMBL1641982
- 89647-61-0
- Aspidinol D
- Q27138734
-
- Inchi： 1S/C13H18O4/c1-5-7(2)12(15)11-9(14)6-10(17-4)8(3)13(11)16/h6-7,14,16H,5H2,1-4H3
- InChI Key： HDRPUFIQLCTRLW-UHFFFAOYSA-N
- SMILES： O=C(C1C(=CC(=C(C)C=1O)OC)O)C(C)CC
Computed Properties
- Exact Mass: 238.121
- Monoisotopic Mass: 238.121
- 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
- Topological Polar Surface Area: 66.8A^2
- XLogP3: 3.2
1-Butanone, 1-(2,6-dihydroxy-4-methoxy-3-methylphenyl)-2-methyl- Related Literature
-
Jason Y. C. Lim,Yong Yu,Guorui Jin,Kai Li,Yi Lu,Jianping Xie Nanoscale Adv., 2020,2, 3921-3932
-
Erika A. Cobar,Paul R. Horn,Robert G. Bergman,Martin Head-Gordon Phys. Chem. Chem. Phys., 2012,14, 15328-15339
-
Ziyang Deng,Changwei Chen,Sunliang Cui RSC Adv., 2016,6, 93753-93755
-
Joo Chuan Yeo,Kenry Lab Chip, 2016,16, 4082-4090
-
Gloria Belén Ramírez-Rodríguez,José Manuel Delgado-López,Jaime Gómez-Morales CrystEngComm, 2013,15, 2206-2212
89647-61-0 (1-Butanone, 1-(2,6-dihydroxy-4-methoxy-3-methylphenyl)-2-methyl-) Related Products
- 116384-24-8(Loureirin C)
- 119425-90-0(Loureirin B)
- 956103-79-0(Cochinchinenin C)
- 400603-95-4(3-(2,4-Dihydroxy-5-(3-(4-hydroxy-2-methoxyphenyl)-1-(4-hydroxyphenyl)propyl)phenyl)-1-(4-hydroxyphenyl)propan-1-one)
- 2098070-20-1(2-(3-(Pyridin-3-yl)-1H-pyrazol-1-yl)acetimidamide)
- 2680771-01-9(4-cyclopentyl-3-{(prop-2-en-1-yloxy)carbonylamino}butanoic acid)
- 1444113-98-7(N-(3-cyanothiolan-3-yl)-2-[(2,2,2-trifluoroethyl)sulfanyl]pyridine-4-carboxamide)
- 332062-08-5(Fmoc-S-3-amino-4,4-diphenyl-butyric acid)
- 1270529-38-8(1,2,3,4,5,6-Hexahydro-[2,3]bipyridinyl-6-ol)
- 941977-17-9(N'-(3-chloro-2-methylphenyl)-N-2-(dimethylamino)-2-(naphthalen-1-yl)ethylethanediamide)
Recommended suppliers
Zhejiang Brunova Technology Co., Ltd.
Gold Member
Audited Supplier
CN Supplier
Bulk
SunaTech Inc.
Gold Member
Audited Supplier
CN Supplier
Reagent
Essenoi Fine Chemical Co., Limited
Gold Member
Audited Supplier
CN Supplier
Reagent
Shanghai Hongxiang Biomedical Technology Co., Ltd.
Gold Member
Audited Supplier
CN Supplier
Bulk
Jiangsu Kolod Food Ingredients Co.,ltd
Gold Member
Audited Supplier
CN Supplier
Bulk
