6-(trifluoromethyl)pyridine-3-carbothioamide

6-(trifluoromethyl)pyridine-3-carbothioamide

CAS: 386715-34-0

Formula: C7H5F3N2S

SMILES: NC(=S)C1=CC=C(N=C1)C(F)(F)F

IUPAC: 6-(trifluoromethyl)pyridine-3-carbothioamide

InChI: InChI=1S/C7H5F3N2S/c8-7(9,10)5-2-1-4(3-12-5)6(11)13/h1-3H,(H2,11,13)

Composition: C (40.78%), H (2.44%), F (27.64%), N (13.59%), S (15.55%)

Molar Mass: 206.19

Atom Count: 18

Heavy Atom Count: 13

Properties

Properties

Common Names	N/A
Aromatic Ring Count	1
Asymmetric Atom Count	0
Exact Mass	206.012553832
Formal Charge	0
FSP3	0.14
Hetero Ring Count	1
Hydrogen Bond Acceptor Count	1
Hydrogen Bond Donor Count	1
InChIKey	PDBGSSVKKHIEBN-UHFFFAOYSA-N
Lipinski's Rule of Five	1
Molar Refractivity	46.57
Topological Polar Surface Area	38.91
Polarizability	16.81
Ring Count	1
Rotatable Bond Count	2

Suppliers

Molecule Market Select

Purity	LeadTime	CAS	PacketSize	UnitPrice
95%	<5 Days	386715-34-0		$83.23$83.23