Cas no 948292-54-4 ( )
structure
Product Name:
CAS No:948292-54-4
MF:C11H9F3N2
MW:226.197772741318
CID:869485
PubChem ID:17039845
Update Time:2025-04-19
Chemical and Physical Properties
Names and Identifiers
-
- 2-methyl-6-(trifluoromethyl)quinolin-4-amine
- 4-AMINO-2-METHYL-6-TRIFLUOROMETHYLQUINOLINE
- 2-Methyl-6-trifluoromethyl-quinolin-4-ylamine
- BB 0241064
- 948292-54-4
- NSNCJGFDMIRSNJ-UHFFFAOYSA-N
- AKOS005199579
- SCHEMBL437638
- AB52032
- MFCD09787702
- DTXSID60589028
-
-
- Inchi: 1S/C11H9F3N2/c1-6-4-9(15)8-5-7(11(12,13)14)2-3-10(8)16-6/h2-5H,1H3,(H2,15,16)
- InChI Key: NSNCJGFDMIRSNJ-UHFFFAOYSA-N
- SMILES: FC(C1C=CC2C(C=1)=C(C=C(C)N=2)N)(F)F
Computed Properties
- Exact Mass: 226.07200
- Monoisotopic Mass: 226.07178278g/mol
- Isotope Atom Count: 0
- Hydrogen Bond Donor Count: 1
- Hydrogen Bond Acceptor Count: 5
- Heavy Atom Count: 16
- Rotatable Bond Count: 0
- Complexity: 254
- 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: 2.8
- Topological Polar Surface Area: 38.9?2
Experimental Properties
- PSA: 38.91000
- LogP: 3.72540
Related Literature
-
Thi Thu Tram Nguyen,Thanh Binh Nguyen Org. Biomol. Chem., 2021,19, 6015-6020
-
Maomao Hou,Fenglin Zhong,Qiu Jin,Enjiang Liu,Jie Feng,Tengyun Wang,Yue Gao RSC Adv., 2017,7, 34392-34400
-
Xing Zhao,Lu Bai,Rui-Ying Bao,Zheng-Ying Liu,Ming-Bo Yang,Wei Yang RSC Adv., 2017,7, 46297-46305
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