Cas no 948291-18-7 (2-chloro-3-(chloromethyl)-6-methyl-quinoline)
948291-18-7 structure
Product Name:2-chloro-3-(chloromethyl)-6-methyl-quinoline
CAS No:948291-18-7
MF:C11H9Cl2N
MW:226.101860761642
CID:870886
PubChem ID:17039796
Update Time:2025-04-19
2-chloro-3-(chloromethyl)-6-methyl-quinoline Chemical and Physical Properties
Names and Identifiers
-
- 2-chloro-3-(chloromethyl)-6-methyl-quinoline
- 2-chloro-3-(chloromethyl)-6-methylquinoline
- 2-CHLORO-3-CHLOROMETHYL-6-METHYLQUINOLINE
- 2-chloro-3-(chloromethyl)6-methylquinoline
- FT-0743328
- DTXSID30588982
- SCHEMBL14617051
- AB42545
- MFCD07780130
- 948291-18-7
-
- Inchi： 1S/C11H9Cl2N/c1-7-2-3-10-8(4-7)5-9(6-12)11(13)14-10/h2-5H,6H2,1H3
- InChI Key： QTVPGRBERZUJGG-UHFFFAOYSA-N
- SMILES： ClC1=C(CCl)C=C2C=C(C)C=CC2=N1
Computed Properties
- Exact Mass: 225.01100
- Monoisotopic Mass: 225.0112047g/mol
- Isotope Atom Count: 0
- Hydrogen Bond Donor Count: 0
- Hydrogen Bond Acceptor Count: 1
- Heavy Atom Count: 14
- Rotatable Bond Count: 1
- Complexity: 198
- 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: 3.9
- Topological Polar Surface Area: 12.9?2
Experimental Properties
- PSA: 12.89000
- LogP: 3.93540
2-chloro-3-(chloromethyl)-6-methyl-quinoline Related Literature
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Fuming Xiao,Mengzhu Wang,Yunxiang Lei,Wenbo Dai,Yunbing Zhou,Miaochang Liu,Wenxia Gao,Xiaobo Huang,Huayue Wu J. Mater. Chem. C, 2020,8, 17410-17416
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Jieun Kim,Han-Saem Park,Tae-Hee Kim,Sung Yeol Kim,Hyun-Kon Song Phys. Chem. Chem. Phys., 2014,16, 5295-5300
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M. Sheykhan,S. Khani,S. Shaabanzadeh,M. Joafshan Green Chem., 2017,19, 5940-5948
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Doug Ogrin,Laura H. van Poppel,Simon G. Bott,Andrew R. Barron Dalton Trans., 2004, 3689-3694
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M. T. Colomer,S. Díaz-Moreno,A. Tamayo,A. L. Ortiz J. Mater. Chem. C, 2018,6, 12643-12651
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