Cas no 13669-66-4 (6-Chloroquinoline-3-carbonitrile)
13669-66-4 structure
Product Name:6-Chloroquinoline-3-carbonitrile
CAS No:13669-66-4
MF:C10H5ClN2
MW:188.613100767136
CID:1084405
PubChem ID:66485283
Update Time:2025-04-20
6-Chloroquinoline-3-carbonitrile Chemical and Physical Properties
Names and Identifiers
-
- 6-Chloroquinoline-3-carbonitrile
- 6-Chloro-3-quinolinecarbonitrile
- 3-Quinolinecarbonitrile, 6-chloro-
- AKOS015831447
- 13669-66-4
- DTXSID201303073
- DB-399479
-
- Inchi： 1S/C10H5ClN2/c11-9-1-2-10-8(4-9)3-7(5-12)6-13-10/h1-4,6H
- InChI Key： DSTLUHCGCLXVMW-UHFFFAOYSA-N
- SMILES： ClC1C=CC2C(=CC(C#N)=CN=2)C=1
Computed Properties
- Exact Mass: 188.0141259g/mol
- Monoisotopic Mass: 188.0141259g/mol
- Isotope Atom Count: 0
- Hydrogen Bond Donor Count: 0
- Hydrogen Bond Acceptor Count: 2
- Heavy Atom Count: 13
- Rotatable Bond Count: 0
- Complexity: 232
- 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: 2.2
- Topological Polar Surface Area: 36.7?2
6-Chloroquinoline-3-carbonitrile Related Literature
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Andre Prates Pereira,Tao Dong,Eric P. Knoshaug,Nick Nagle,Ryan Spiller,Bonnie Panczak,Christopher J. Chuck,Philip T. Pienkos Sustainable Energy Fuels, 2020,4, 3400-3408
-
S. Amaresh,K. Karthikeyan,K. J. Kim,Y. S. Lee RSC Adv., 2014,4, 23107-23115
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Jialiang Yuan,Ran Dong,Yuan Li,Yang Liu,Zhuo Zheng,Yuxia Liu,Yan Sun,Benhe Zhong,Zhenguo Wu,Xiaodong Guo Chem. Commun., 2021,57, 13004-13007
-
Raheleh Torabi,Hedayatollah Ghourchian,Massoud Amanlou Org. Biomol. Chem., 2016,14, 8141-8153
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