Cas no 83562-16-7 (5-amino-1-Isoquinolinecarbonitrile)
83562-16-7 structure
Product Name:5-amino-1-Isoquinolinecarbonitrile
CAS No:83562-16-7
MF:C10H7N3
MW:169.182681322098
CID:709011
PubChem ID:12791861
Update Time:2025-04-19
5-amino-1-Isoquinolinecarbonitrile Chemical and Physical Properties
Names and Identifiers
-
- 5-amino-1-Isoquinolinecarbonitrile
- 1-Isoquinolinecarbonitrile,5-amino-
- 1-Isoquinolinecarbonitrile,5-amino-(9CI)
- SCHEMBL3939571
- AUCNLSUCVJKOPW-UHFFFAOYSA-N
- 5-aminoisoquinoline-1-carbonitrile
- AKOS006306124
- 83562-16-7
-
- Inchi： 1S/C10H7N3/c11-6-10-8-2-1-3-9(12)7(8)4-5-13-10/h1-5H,12H2
- InChI Key： AUCNLSUCVJKOPW-UHFFFAOYSA-N
- SMILES： N1C=CC2C(=CC=CC=2C=1C#N)N
Computed Properties
- Exact Mass: 169.063997236g/mol
- Monoisotopic Mass: 169.063997236g/mol
- Isotope Atom Count: 0
- Hydrogen Bond Donor Count: 1
- Hydrogen Bond Acceptor Count: 3
- Heavy Atom Count: 13
- Rotatable Bond Count: 0
- Complexity: 230
- 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: 1.5
- Topological Polar Surface Area: 62.7?2
5-amino-1-Isoquinolinecarbonitrile Related Literature
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Hanie Hashtroudi,Ian D. R. Mackinnon J. Mater. Chem. C, 2020,8, 13108-13126
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Maomao Hou,Fenglin Zhong,Qiu Jin,Enjiang Liu,Jie Feng,Tengyun Wang,Yue Gao RSC Adv., 2017,7, 34392-34400
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Marcin Czapla,Jack Simons Phys. Chem. Chem. Phys., 2018,20, 21739-21745
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4. Fatty acid eutectic mixtures and derivatives from non-edible animal fat as phase change materials?Pau Gallart-Sirvent,Marc Martín,Gemma Villorbina,Mercè Balcells,Aran Solé,Luisa F. Cabeza,Ramon Canela-Garayoa RSC Adv., 2017,7, 24133-24139
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Zhixia Liu,Tingjian Chen,Floyd E. Romesberg Chem. Sci., 2017,8, 8179-8182
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