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4-(trifluoromethyl)isoquinolin-6-amine

4-(trifluoromethyl)isoquinolin-6-amine

Formula: C10H7F3N2

SMILES: NC1=CC2=C(C=NC=C2C=C1)C(F)(F)F

IUPAC: 4-(trifluoromethyl)isoquinolin-6-amine

InChI: InChI=1S/C10H7F3N2/c11-10(12,13)9-5-15-4-6-1-2-7(14)3-8(6)9/h1-5H,14H2

Composition: C (56.61%), H (3.33%), F (26.86%), N (13.20%)

Molar Mass: 212.175

Atom Count: 22

Heavy Atom Count: 15

Properties
Properties
Common Names N/A
Aromatic Ring Count 2
Asymmetric Atom Count 0
Exact Mass 212.056132722
Formal Charge 0
FSP3 0.1
Hetero Ring Count 1
Hydrogen Bond Acceptor Count 2
Hydrogen Bond Donor Count 1
InChIKey UGVAQPOXFBRNJQ-UHFFFAOYSA-N
Lipinski's Rule of Five 1
Molar Refractivity 51.03
Topological Polar Surface Area 38.91
Polarizability 19.08
Ring Count 2
Rotatable Bond Count 1

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Purity (%)
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Molecule Market Select
Purity LeadTime Formula UnitPrice
98% <10 Days C10H7F3N2 Quote Only