methyl 3-(thiophen-2-yl)-6-(trifluoromethyl)thieno[3,2-b]pyridine-2-carboxylate

methyl 3-(thiophen-2-yl)-6-(trifluoromethyl)thieno[3,2-b]pyridine-2-carboxylate

CAS: 478048-35-0

Formula: C14H8F3NO2S2

SMILES: COC(=O)C1=C(C2=CC=CS2)C2=NC=C(C=C2S1)C(F)(F)F

IUPAC: methyl 3-(thiophen-2-yl)-6-(trifluoromethyl)thieno[3,2-b]pyridine-2-carboxylate

InChI: InChI=1S/C14H8F3NO2S2/c1-20-13(19)12-10(8-3-2-4-21-8)11-9(22-12)5-7(6-18-11)14(15,16)17/h2-6H,1H3

Composition: C (48.98%), H (2.35%), F (16.60%), N (4.08%), O (9.32%), S (18.68%)

Molar Mass: 343.34

Atom Count: 30

Heavy Atom Count: 22

Properties

Properties

Common Names	N/A
Aromatic Ring Count	3
Asymmetric Atom Count	0
Exact Mass	342.994855339
Formal Charge	0
FSP3	0.14
Hetero Ring Count	3
Hydrogen Bond Acceptor Count	2
Hydrogen Bond Donor Count	0
InChIKey	RCIRVWNMADHUIF-UHFFFAOYSA-N
Lipinski's Rule of Five	1
Molar Refractivity	76.68
Topological Polar Surface Area	39.19
Polarizability	30.75
Ring Count	3
Rotatable Bond Count	4

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Purity	LeadTime	CAS	PacketSize	UnitPrice
90%	<2 Days	478048-35-0		$51.35-$524.40$51.35$63.37$86.31$524.40