Cas no 27311-64-4 (4-Isoquinolinol,1-methyl-)
4-Isoquinolinol,1-methyl- structure
Product Name:4-Isoquinolinol,1-methyl-
CAS No:27311-64-4
MF:C10H9NO
MW:159.184562444687
CID:251006
PubChem ID:11084156
Update Time:2025-04-19
4-Isoquinolinol,1-methyl- Chemical and Physical Properties
Names and Identifiers
-
- 4-Isoquinolinol,1-methyl-
- 1-methylisoquinolin-4-ol
- 1-Methyl-4-hydroxyisoquinoline
- 1-Methyl-4-isoquinolinol
- 4-Hydroxy-1-methylisoquinoline
- 4-Isoquinolinol,1-methyl-(8CI,9CI)
- DTXSID901313368
- SCHEMBL1563993
- 27311-64-4
-
- Inchi： 1S/C10H9NO/c1-7-8-4-2-3-5-9(8)10(12)6-11-7/h2-6,12H,1H3
- InChI Key： FGISAWMEMVYNRJ-UHFFFAOYSA-N
- SMILES： OC1=CN=C(C)C2C=CC=CC=21
Computed Properties
- Exact Mass: 159.06847
- Monoisotopic Mass: 159.068413911g/mol
- Isotope Atom Count: 0
- Hydrogen Bond Donor Count: 1
- Hydrogen Bond Acceptor Count: 2
- Heavy Atom Count: 12
- Rotatable Bond Count: 0
- Complexity: 160
- 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: 2.1
- Topological Polar Surface Area: 33.1?2
Experimental Properties
- PSA: 33.12
4-Isoquinolinol,1-methyl- Related Literature
-
Zhixia Liu,Tingjian Chen,Floyd E. Romesberg Chem. Sci., 2017,8, 8179-8182
-
Tengfei Yu,Yuehan Wu,Wei Li,Bin Li RSC Adv., 2014,4, 34134-34143
-
Thi Thu Tram Nguyen,Thanh Binh Nguyen Org. Biomol. Chem., 2021,19, 6015-6020
-
Xiaoming Liu,Zachary D. Hood,Wangda Li,Donovan N. Leonard,Arumugam Manthiram,Miaofang Chi J. Mater. Chem. A, 2021,9, 2111-2119
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