1-[3-(pyridin-2-yl)-1,2,4-oxadiazol-5-yl]methanamine; trifluoroacetic acid

1-[3-(pyridin-2-yl)-1,2,4-oxadiazol-5-yl]methanamine; trifluoroacetic acid

CAS: 1255717-30-6

Formula: C10H9F3N4O3

SMILES: OC(=O)C(F)(F)F.NCC1=NC(=NO1)C1=NC=CC=C1

IUPAC: 1-[3-(pyridin-2-yl)-1,2,4-oxadiazol-5-yl]methanamine; trifluoroacetic acid

InChI: InChI=1S/C8H8N4O.C2HF3O2/c9-5-7-11-8(12-13-7)6-3-1-2-4-10-6;3-2(4,5)1(6)7/h1-4H,5,9H2;(H,6,7)

Composition: C (41.39%), H (3.13%), F (19.64%), N (19.31%), O (16.54%)

Molar Mass: 290.202

Atom Count: 29

Heavy Atom Count: 20

Properties

Properties

Common Names	N/A
Aromatic Ring Count	2
Asymmetric Atom Count	0
Exact Mass	290.062674655
Formal Charge	0
FSP3	0.2
Hetero Ring Count	2
Hydrogen Bond Acceptor Count	4
Hydrogen Bond Donor Count	1
InChIKey	MRJWULRQWTYKKF-UHFFFAOYSA-N
Lipinski's Rule of Five	1
Molar Refractivity	57.36
Topological Polar Surface Area	77.83
Polarizability	18.2
Ring Count	2
Rotatable Bond Count	3

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95%	<4 Days	1255717-30-6		$28.75-$708.40$28.75$93.15$189.75$708.40