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541539-78-0

541539-78-0 | 4-(2-Aminoethylthio)-8-fluoro-2-(trifluoromethyl)quinoline

CAS No: 541539-78-0 Catalog No: AG01FGD0 MDL No:

Product Description

Catalog Number:
AG01FGD0
Chemical Name:
4-(2-Aminoethylthio)-8-fluoro-2-(trifluoromethyl)quinoline
CAS Number:
541539-78-0
IUPAC Name:
2-[8-fluoro-2-(trifluoromethyl)quinolin-4-yl]sulfanylethanamine
InChI:
InChI=1S/C12H10F4N2S/c13-8-3-1-2-7-9(19-5-4-17)6-10(12(14,15)16)18-11(7)8/h1-3,6H,4-5,17H2
InChI Key:
ORBZAAFUCWIVQM-UHFFFAOYSA-N

Properties

Complexity:
300  
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1  
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
290.05g/mol
Formal Charge:
0
Heavy Atom Count:
19  
Hydrogen Bond Acceptor Count:
7  
Hydrogen Bond Donor Count:
1  
Isotope Atom Count:
0
Molecular Weight:
290.28g/mol
Monoisotopic Mass:
290.05g/mol
Rotatable Bond Count:
3  
Topological Polar Surface Area:
64.2A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
2.8  

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