Cas no 1219101-08-2 (6-chloro-2-chlorosulfonylquinoline)
1219101-08-2 structure
Product Name:6-chloro-2-chlorosulfonylquinoline
CAS No:1219101-08-2
MF:C9H5Cl2NO2S
MW:262.112498998642
CID:2887899
PubChem ID:102164253
Update Time:2025-04-21
6-chloro-2-chlorosulfonylquinoline Chemical and Physical Properties
Names and Identifiers
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- 6-chloro-2-chlorosulfonylquinoline
- 1219101-08-2
- 6-Chloroquinoline-2-sulfonyl chloride
- 6-Chloroquinoline-2-sulfonylchloride
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- Inchi： 1S/C9H5Cl2NO2S/c10-7-2-3-8-6(5-7)1-4-9(12-8)15(11,13)14/h1-5H
- InChI Key： XFPQDPMMBOWZMI-UHFFFAOYSA-N
- SMILES： ClS(C1=CC=C2C=C(C=CC2=N1)Cl)(=O)=O
Computed Properties
- Exact Mass: 260.94200
- Monoisotopic Mass: 260.9418050Da
- Isotope Atom Count: 0
- Hydrogen Bond Donor Count: 0
- Hydrogen Bond Acceptor Count: 3
- Heavy Atom Count: 15
- Rotatable Bond Count: 1
- Complexity: 327
- 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: 3.2
- Topological Polar Surface Area: 55.4?2
Experimental Properties
- PSA: 55.41000
- LogP: 3.89650
6-chloro-2-chlorosulfonylquinoline Related Literature
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J. M. Granadino-Roldán,M. Fernández-Gómez,A. Navarro,T. Pe?a Ruiz,U. A. Jayasooriya Phys. Chem. Chem. Phys., 2004,6, 1133-1143
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Kaiyuan Huang,Wangkang Qiu,Meilian Ou,Xiaorui Liu,Zenan Liao,Sheng Chu RSC Adv., 2020,10, 18824-18829
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Luis Miguel Azofra,Douglas R. MacFarlane,Chenghua Sun Chem. Commun., 2016,52, 3548-3551
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Chongyang Zhu,Xiaojia Bian,Xin Jia,Ning Tang,Yongqiang Cheng Food Funct., 2020,11, 10635-10644
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Kanjun Sun,Fengting Hua,Shuzhen Cui,Yanrong Zhu,Hui Peng,Guofu Ma RSC Adv., 2021,11, 37631-37642
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