Cas no 1175272-31-7 (2,3-dihydro-3-oxo-5-Isoquinolinecarbonitrile)
1175272-31-7 structure
Product Name:2,3-dihydro-3-oxo-5-Isoquinolinecarbonitrile
CAS No:1175272-31-7
MF:C10H6N2O
MW:170.16744184494
CID:1100619
PubChem ID:67520562
Update Time:2025-04-20
2,3-dihydro-3-oxo-5-Isoquinolinecarbonitrile Chemical and Physical Properties
Names and Identifiers
-
- 2,3-dihydro-3-oxo-5-Isoquinolinecarbonitrile
- 3-Hydroxy-5-isoquinolinecarbonitrile
- 1,2-DIHYDRO-INDOL-3-ONE
- 1,2-Dimethylindole-3-carboxaldehyde
- 1-Boc-1H-Indol-3-ol
- 3-Hydroxy-1H-indole
- 3-hydroxyindole
- 3-hydroxyisoquinoline-5-carbonitrile
- indole-3-ol
- RARECHEM AH BS 0105
- 1175272-31-7
- DB-376091
- SCHEMBL2748021
-
- Inchi： 1S/C10H6N2O/c11-5-7-2-1-3-8-6-12-10(13)4-9(7)8/h1-4,6H,(H,12,13)
- InChI Key： GJHRWZDMNLGYQX-UHFFFAOYSA-N
- SMILES： O=C1C=C2C(C#N)=CC=CC2=CN1
Computed Properties
- Exact Mass: 170.048012819g/mol
- Monoisotopic Mass: 170.048012819g/mol
- Isotope Atom Count: 0
- Hydrogen Bond Donor Count: 1
- Hydrogen Bond Acceptor Count: 2
- Heavy Atom Count: 13
- Rotatable Bond Count: 0
- Complexity: 441
- 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: 0
- Topological Polar Surface Area: 52.9?2
2,3-dihydro-3-oxo-5-Isoquinolinecarbonitrile Related Literature
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Chandran Rajendran,Govindaswamy Satishkumar,Charlotte Lang,Eric M. Gaigneaux Catal. Sci. Technol., 2020,10, 2583-2592
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Jianyao Huang,Dong Gao,Zhihui Chen,Weifeng Zhang Polym. Chem., 2021,12, 2471-2480
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Hyejin Moon,Aaron R. Wheeler,Robin L. Garrell,Chang-Jin “CJ” Kim Lab Chip, 2006,6, 1213-1219
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Supaporn Sawadjoon,Joseph S. M. Samec Org. Biomol. Chem., 2011,9, 2548-2554
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Muniyandi Sankaralingam,So Hyun Jeon,Yong-Min Lee,Mi Sook Seo,Wonwoo Nam Dalton Trans., 2016,45, 376-383
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