6-[3-(trifluoromethyl)phenyl]-1,3,5-triazine-2,4-diamine

6-[3-(trifluoromethyl)phenyl]-1,3,5-triazine-2,4-diamine

CAS: 30508-78-2

Formula: C10H8F3N5

SMILES: NC1=NC(=NC(N)=N1)C1=CC=CC(=C1)C(F)(F)F

IUPAC: 6-[3-(trifluoromethyl)phenyl]-1,3,5-triazine-2,4-diamine

InChI: InChI=1S/C10H8F3N5/c11-10(12,13)6-3-1-2-5(4-6)7-16-8(14)18-9(15)17-7/h1-4H,(H4,14,15,16,17,18)

Composition: C (47.06%), H (3.16%), F (22.33%), N (27.44%)

Molar Mass: 255.204

Atom Count: 26

Heavy Atom Count: 18

Properties

Properties

Common Names	N/A
Aromatic Ring Count	2
Asymmetric Atom Count	0
Exact Mass	255.073179767
Formal Charge	0
FSP3	0.1
Hetero Ring Count	1
Hydrogen Bond Acceptor Count	5
Hydrogen Bond Donor Count	2
InChIKey	YMIFDDZCSSDQHL-UHFFFAOYSA-N
Lipinski's Rule of Five	1
Molar Refractivity	73.2
Topological Polar Surface Area	90.71
Polarizability	21.39
Ring Count	2
Rotatable Bond Count	2

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