ethyl 6-(trifluoromethyl)pyridine-3-carboxylate

ethyl 6-(trifluoromethyl)pyridine-3-carboxylate

CAS: 597532-36-0

Formula: C9H8F3NO2

SMILES: CCOC(=O)C1=CN=C(C=C1)C(F)(F)F

IUPAC: ethyl 6-(trifluoromethyl)pyridine-3-carboxylate

InChI: InChI=1S/C9H8F3NO2/c1-2-15-8(14)6-3-4-7(13-5-6)9(10,11)12/h3-5H,2H2,1H3

Composition: C (49.32%), H (3.68%), F (26.01%), N (6.39%), O (14.60%)

Molar Mass: 219.163

Atom Count: 23

Heavy Atom Count: 15

Properties

Properties

Common Names	N/A
Aromatic Ring Count	1
Asymmetric Atom Count	0
Exact Mass	219.050712991
Formal Charge	0
FSP3	0.33
Hetero Ring Count	1
Hydrogen Bond Acceptor Count	2
Hydrogen Bond Donor Count	0
InChIKey	NRFRJTLIEGYCOA-UHFFFAOYSA-N
Lipinski's Rule of Five	1
Molar Refractivity	46.28
Topological Polar Surface Area	39.19
Polarizability	17.04
Ring Count	1
Rotatable Bond Count	4

Suppliers

Struchem co.,ltd

Supplier Profile

Purity	LeadTime	CAS	PacketSize	UnitPrice
95%	<5 Days	597532-36-0		$1,300.00-$2,860.00$1,300.00$1,860.00$2,860.00

MATRIX SCIENTIFIC

Supplier Profile

Purity	LeadTime	CAS	PacketSize	UnitPrice
97%	<2 Days	597532-36-0		$58.82-$638.49$58.82$206.41$638.49