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1133115-85-1 | 6-(Trifluoromethoxy)quinolin-5-amine
CAS No: 1133115-85-1 Catalog No: AG003N08 MDL No:MFCD11855901
Product Description
Catalog Number:
AG003N08
Chemical Name:
6-(Trifluoromethoxy)quinolin-5-amine
CAS Number:
1133115-85-1
Molecular Formula:
C10H7F3N2O
Molecular Weight:
228.1706
MDL Number:
MFCD11855901
IUPAC Name:
6-(trifluoromethoxy)quinolin-5-amine
InChI:
InChI=1S/C10H7F3N2O/c11-10(12,13)16-8-4-3-7-6(9(8)14)2-1-5-15-7/h1-5H,14H2
InChI Key:
LQSPPETUJPXBHI-UHFFFAOYSA-N
SMILES:
Nc1c(ccc2c1cccn2)OC(F)(F)F
Properties
Complexity:
247
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
228.051g/mol
Formal Charge:
0
Heavy Atom Count:
16
Hydrogen Bond Acceptor Count:
6
Hydrogen Bond Donor Count:
1
Isotope Atom Count:
0
Molecular Weight:
228.174g/mol
Monoisotopic Mass:
228.051g/mol
Rotatable Bond Count:
1
Topological Polar Surface Area:
48.1A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
2.7
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