ethyl 2-amino-6-(trifluoromethyl)pyridine-3-carboxylate

ethyl 2-amino-6-(trifluoromethyl)pyridine-3-carboxylate

Formula: C9H9F3N2O2

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

IUPAC: ethyl 2-amino-6-(trifluoromethyl)pyridine-3-carboxylate

InChI: InChI=1S/C9H9F3N2O2/c1-2-16-8(15)5-3-4-6(9(10,11)12)14-7(5)13/h3-4H,2H2,1H3,(H2,13,14)

Composition: C (46.16%), H (3.87%), F (24.34%), N (11.96%), O (13.66%)

Molar Mass: 234.178

Atom Count: 25

Heavy Atom Count: 16

Properties

Properties

Common Names	N/A
Aromatic Ring Count	1
Asymmetric Atom Count	0
Exact Mass	234.061612027
Formal Charge	0
FSP3	0.33
Hetero Ring Count	1
Hydrogen Bond Acceptor Count	3
Hydrogen Bond Donor Count	1
InChIKey	SYWBXHBOURLVKO-UHFFFAOYSA-N
Lipinski's Rule of Five	1
Molar Refractivity	51.29
Topological Polar Surface Area	65.21
Polarizability	18.22
Ring Count	1
Rotatable Bond Count	4

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Purity	LeadTime	Formula		UnitPrice
98%	<10 Days	C9H9F3N2O2		Quote Only