Cas no 129724-30-7 (Canthin-2,6-dione; 4-Methoxy, 5-hydroxy, N3-Me)
129724-30-7 structure
Product Name:Canthin-2,6-dione; 4-Methoxy, 5-hydroxy, N3-Me
CAS No:129724-30-7
MF:C16H12N2O4
MW:296.277483940125
CID:6646718
PubChem ID:118728713
Update Time:2024-03-02
Canthin-2,6-dione; 4-Methoxy, 5-hydroxy, N3-Me Chemical and Physical Properties
Names and Identifiers
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- Canthin-2,6-dione; 4-Methoxy, 5-hydroxy, N3-Me
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- Inchi: 1S/C16H12N2O4/c1-17-11(19)7-9-8-5-3-4-6-10(8)18-12(9)13(17)15(22-2)14(20)16(18)21/h3-7,20H,1-2H3
- InChI Key: CQFOPDQAOBCODL-UHFFFAOYSA-N
- SMILES: O(C)C1=C(C(N2C3C=CC=CC=3C3=CC(N(C)C1=C23)=O)=O)O
Computed Properties
- Exact Mass: 296.07970687g/mol
- Monoisotopic Mass: 296.07970687g/mol
- Isotope Atom Count: 0
- Hydrogen Bond Donor Count: 1
- Hydrogen Bond Acceptor Count: 4
- Heavy Atom Count: 22
- Rotatable Bond Count: 1
- Complexity: 688
- 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: 0.1
- Topological Polar Surface Area: 70.1?2
Canthin-2,6-dione; 4-Methoxy, 5-hydroxy, N3-Me Related Literature
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Hyejin Moon,Aaron R. Wheeler,Robin L. Garrell,Chang-Jin “CJ” Kim Lab Chip, 2006,6, 1213-1219
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Bo Cao,Yin Wei Chem. Commun., 2018,54, 2870-2873
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José M. Rivera,Mariana Martín-Hidalgo,Jean C. Rivera-Ríos Org. Biomol. Chem., 2012,10, 7562-7565
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Supaporn Sawadjoon,Joseph S. M. Samec Org. Biomol. Chem., 2011,9, 2548-2554
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Jingquan Liu,Huiyun Liu,Zhongfan Jia,Volga Bulmus,Thomas P. Davis Chem. Commun., 2008, 6582-6584
129724-30-7 (Canthin-2,6-dione; 4-Methoxy, 5-hydroxy, N3-Me) Related Products
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