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6-[4-(trifluoromethyl)phenyl]pyrazin-2-amine

6-[4-(trifluoromethyl)phenyl]pyrazin-2-amine

CAS: 1159819-32-5

Formula: C11H8F3N3

SMILES: NC1=NC(=CN=C1)C1=CC=C(C=C1)C(F)(F)F

IUPAC: 6-[4-(trifluoromethyl)phenyl]pyrazin-2-amine

InChI: InChI=1S/C11H8F3N3/c12-11(13,14)8-3-1-7(2-4-8)9-5-16-6-10(15)17-9/h1-6H,(H2,15,17)

Composition: C (55.23%), H (3.37%), F (23.83%), N (17.57%)

Molar Mass: 239.201

Atom Count: 25

Heavy Atom Count: 17

Properties
Properties
Common Names N/A
Aromatic Ring Count 2
Asymmetric Atom Count 0
Exact Mass 239.067031759
Formal Charge 0
FSP3 0.09
Hetero Ring Count 1
Hydrogen Bond Acceptor Count 3
Hydrogen Bond Donor Count 1
InChIKey MDUPHOABUVMRGM-UHFFFAOYSA-N
Lipinski's Rule of Five 1
Molar Refractivity 57.5
Topological Polar Surface Area 51.8
Polarizability 21.64
Ring Count 2
Rotatable Bond Count 2

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