Cas no 656233-97-5 (5-Isoquinolinol, 4-(3-aminophenyl)-1-methoxy-)
656233-97-5 structure
Product Name:5-Isoquinolinol, 4-(3-aminophenyl)-1-methoxy-
CAS No:656233-97-5
MF:C16H14N2O2
MW:266.294563770294
CID:398054
PubChem ID:71375619
Update Time:2025-04-19
5-Isoquinolinol, 4-(3-aminophenyl)-1-methoxy- Chemical and Physical Properties
Names and Identifiers
-
- 5-Isoquinolinol, 4-(3-aminophenyl)-1-methoxy-
- 4-(3-aminophenyl)-1-methoxyisoquinolin-5-ol
- DTXSID40798353
- 656233-97-5
-
- Inchi： 1S/C16H14N2O2/c1-20-16-12-6-3-7-14(19)15(12)13(9-18-16)10-4-2-5-11(17)8-10/h2-9,19H,17H2,1H3
- InChI Key： VXGZFQCAPGWPDZ-UHFFFAOYSA-N
- SMILES： O(C)C1C2C=CC=C(C=2C(=CN=1)C1C=CC=C(C=1)N)O
Computed Properties
- Exact Mass: 266.10562
- Monoisotopic Mass: 266.105527694g/mol
- Isotope Atom Count: 0
- Hydrogen Bond Donor Count: 2
- Hydrogen Bond Acceptor Count: 4
- Heavy Atom Count: 20
- Rotatable Bond Count: 2
- Complexity: 326
- 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
- Topological Polar Surface Area: 68.4?2
Experimental Properties
- PSA: 68.37
5-Isoquinolinol, 4-(3-aminophenyl)-1-methoxy- Related Literature
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Alexandre Vimont,Arnaud Travert,Philippe Bazin,Jean-Claude Lavalley,Marco Daturi,Christian Serre,Gérard Férey,Sandrine Bourrelly,Philip L. Llewellyn Chem. Commun., 2007, 3291-3293
-
Weili Dai,Guangjun Wu,Michael Hunger Chem. Commun., 2015,51, 13779-13782
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Chen-Yu Chien,Sheng-Sheng Yu Chem. Commun., 2020,56, 11949-11952
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Jason Wan Lab Chip, 2020,20, 4528-4538
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Thi Thu Tram Nguyen,Thanh Binh Nguyen Org. Biomol. Chem., 2021,19, 6015-6020
656233-97-5 (5-Isoquinolinol, 4-(3-aminophenyl)-1-methoxy-) Related Products
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