Cas no 59412-13-4 (Quinoline, 2,5-dichloro-3-phenyl-)
59412-13-4 structure
Product Name:Quinoline, 2,5-dichloro-3-phenyl-
CAS No:59412-13-4
MF:C15H9Cl2N
MW:274.144661664963
CID:338731
PubChem ID:12278044
Update Time:2025-04-19
Quinoline, 2,5-dichloro-3-phenyl- Chemical and Physical Properties
Names and Identifiers
-
- Quinoline, 2,5-dichloro-3-phenyl-
- 2,5-dichloro-3-phenylquinoline
- DTXSID90483808
- 59412-13-4
- SCHEMBL11599658
-
- Inchi: 1S/C15H9Cl2N/c16-13-7-4-8-14-12(13)9-11(15(17)18-14)10-5-2-1-3-6-10/h1-9H
- InChI Key: MOTALRWMDPNNSC-UHFFFAOYSA-N
- SMILES: ClC1=C(C2C=CC=CC=2)C=C2C(=CC=CC2=N1)Cl
Computed Properties
- Exact Mass: 273.01137
- Monoisotopic Mass: 273.0112047g/mol
- Isotope Atom Count: 0
- Hydrogen Bond Donor Count: 0
- Hydrogen Bond Acceptor Count: 1
- Heavy Atom Count: 18
- Rotatable Bond Count: 1
- Complexity: 278
- 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: 5.4
- Topological Polar Surface Area: 12.9?2
Experimental Properties
- PSA: 12.89
Quinoline, 2,5-dichloro-3-phenyl- Related Literature
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Stephen P. Fletcher,Richard B. C. Jagt,Ben L. Feringa Chem. Commun., 2007, 2578-2580
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Xiang Liu,Qian Sun,A. B. Djuri?i?,Maohai Xie,Baohu Dai,Jinyao Tang,Charles Surya,Changzhong Liao,Kaimin Shih RSC Adv., 2015,5, 100783-100789
-
Alvin Tanudjaja,Shinsuke Inagi,Fusao Kitamura,Toshikazu Takata,Ikuyoshi Tomita Dalton Trans., 2021,50, 3037-3043
-
Huabin Zhang,Shaowu Du CrystEngComm, 2014,16, 4059-4068
-
Chongyang Zhu,Xiaojia Bian,Xin Jia,Ning Tang,Yongqiang Cheng Food Funct., 2020,11, 10635-10644
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