Cas no 152-83-0 (Cinnolin-4-amine)
Cinnolin-4-amine structure
Product Name:Cinnolin-4-amine
CAS No:152-83-0
MF:C8H7N3
MW:145.161280870438
CID:2170796
Update Time:2024-11-26
Cinnolin-4-amine Chemical and Physical Properties
Names and Identifiers
-
- Cinnolin-4-ylamine
- Cinnolin-4-amine
- 4-cinnolinamine
- 4-Aminocinnoline
- cinnoline-4-ylamine
- DODZTSARNRLOKY-UHFFFAOYSA-N
- 7189AB
- SBB086419
- 152C830
-
- Inchi： 1S/C8H7N3/c9-7-5-10-11-8-4-2-1-3-6(7)8/h1-5H,(H2,9,11)
- InChI Key： DODZTSARNRLOKY-UHFFFAOYSA-N
- SMILES： N1C2C=CC=CC=2C(=CN=1)N
Computed Properties
- Isotope Atom Count: 0
- Hydrogen Bond Donor Count: 1
- Hydrogen Bond Acceptor Count: 3
- Heavy Atom Count: 11
- Rotatable Bond Count: 0
- Complexity: 137
- 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
- Topological Polar Surface Area: 51.8
- Surface Charge: 0
- Tautomer Count: 2
Cinnolin-4-amine Related Literature
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Denis V. Korchagin,Elena A. Yureva,Alexander V. Akimov,Eugenii Ya. Misochko,Gennady V. Shilov,Artem D. Talantsev,Roman B. Morgunov,Alexander A. Shakin,Sergey M. Aldoshin,Boris S. Tsukerblat Dalton Trans., 2017,46, 7540-7548
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Zhixia Liu,Tingjian Chen,Floyd E. Romesberg Chem. Sci., 2017,8, 8179-8182
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Craig A. Kelly,David R. Rosseinsky Phys. Chem. Chem. Phys., 2001,3, 2086-2090
-
Ross Harder,David C. Dunand,Ian McNulty Nanoscale, 2017,9, 5686-5693
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Marcin Czapla,Jack Simons Phys. Chem. Chem. Phys., 2018,20, 21739-21745
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