Cas no 66570-51-2 (2,5,8-trimethoxy-4-methylquinoline)
66570-51-2 structure
Product Name:2,5,8-trimethoxy-4-methylquinoline
CAS No:66570-51-2
MF:C13H15NO3
MW:233.263103723526
CID:964210
PubChem ID:269186
Update Time:2025-04-19
2,5,8-trimethoxy-4-methylquinoline Chemical and Physical Properties
Names and Identifiers
-
- 2,5,8-trimethoxy-4-methylquinoline
- 2,5,8-Trimethoxy-4-methyl-chinolin
- 2,5,8-trimethoxy-4-methyl-quinoline
- NSC-109787
- 66570-51-2
- NSC109787
- DTXSID70296534
-
- Inchi： 1S/C13H15NO3/c1-8-7-11(17-4)14-13-10(16-3)6-5-9(15-2)12(8)13/h5-7H,1-4H3
- InChI Key： HDPXPRUSNDOEAU-UHFFFAOYSA-N
- SMILES： O(C)C1=CC=C(C2C1=C(C)C=C(N=2)OC)OC
Computed Properties
- Exact Mass: 233.10500
- Monoisotopic Mass: 233.10519334g/mol
- Isotope Atom Count: 0
- Hydrogen Bond Donor Count: 0
- Hydrogen Bond Acceptor Count: 4
- Heavy Atom Count: 17
- Rotatable Bond Count: 3
- Complexity: 249
- 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: 2.8
- Topological Polar Surface Area: 40.6?2
Experimental Properties
- PSA: 40.58000
- LogP: 2.56900
2,5,8-trimethoxy-4-methylquinoline Related Literature
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Qiao Song,Angela Bamesberger,Lingyun Yang,Haley Houtwed,Haishi Cao Analyst, 2014,139, 3588-3592
-
Vishwesh Venkatraman,Marco Foscato,Vidar R. Jensen,Bj?rn K?re Alsberg J. Mater. Chem. A, 2015,3, 9851-9860
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Xing Zhao,Lu Bai,Rui-Ying Bao,Zheng-Ying Liu,Ming-Bo Yang,Wei Yang RSC Adv., 2017,7, 46297-46305
-
Bin Han,Yasuo Shimizu,Gabriele Seguini,Celia Castro,Gérard Ben Assayag,Koji Inoue,Yasuyoshi Nagai,Sylvie Schamm-Chardon,Michele Perego RSC Adv., 2016,6, 3617-3622
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