4-(trifluoromethyl)pyridine-2-carboxylic acid

4-(trifluoromethyl)pyridine-2-carboxylic acid

CAS: 588702-62-9

Formula: C7H4F3NO2

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

IUPAC: 4-(trifluoromethyl)pyridine-2-carboxylic acid

InChI: InChI=1S/C7H4F3NO2/c8-7(9,10)4-1-2-11-5(3-4)6(12)13/h1-3H,(H,12,13)

Composition: C (43.99%), H (2.11%), F (29.82%), N (7.33%), O (16.74%)

Molar Mass: 191.109

Atom Count: 17

Heavy Atom Count: 13

Properties

Properties

Common Names	N/A
Aromatic Ring Count	1
Asymmetric Atom Count	0
Exact Mass	191.019412862
Formal Charge	0
FSP3	0.14
Hetero Ring Count	1
Hydrogen Bond Acceptor Count	3
Hydrogen Bond Donor Count	1
InChIKey	BPRWTROIQXSSOC-UHFFFAOYSA-N
Lipinski's Rule of Five	1
Molar Refractivity	36.76
Topological Polar Surface Area	50.19
Polarizability	13.29
Ring Count	1
Rotatable Bond Count	2

Suppliers

Life Chemicals USA, Inc.

Supplier Profile

Purity	LeadTime	CAS	PacketSize	UnitPrice
95%	<7 Days	588702-62-9		$18.81-$262.35$18.81$25.74$31.68$74.25$143.55$262.35

AA BLOCKS INC

Supplier Profile

Purity	LeadTime	CAS	PacketSize	UnitPrice
97%	<6 Days	588702-62-9		$4.60-$92.00$4.60$5.75$19.55$48.30$92.00

Molecule Market Select

Purity	LeadTime	CAS	PacketSize	UnitPrice
98%	<7 Days	588702-62-9		$7.25-$1,162.31$7.25$18.63$62.10$121.10$292.91$1,162.31

Key Organics Ltd

Supplier Profile

Purity	LeadTime	CAS	PacketSize	UnitPrice
97%	<2 Days	588702-62-9		$51.35-$764.75$51.35$63.37$86.31$163.88$314.64$764.75

Struchem co.,ltd

Supplier Profile

Purity	LeadTime	CAS	PacketSize	UnitPrice
95%	<5 Days	588702-62-9		$517.00-$738.00$517.00$738.00

Kinentia Biosciences LLC

Supplier Profile

Purity	LeadTime	CAS	PacketSize	UnitPrice
97%	<14 Days	588702-62-9		$94.50-$1,196.37$94.50$1,196.37

Molecule Market Select

Purity	LeadTime	CAS	PacketSize	UnitPrice
97%	<5 Days	588702-62-9		$7.57-$166.45$7.57$12.61$36.57$166.45

MATRIX SCIENTIFIC

Supplier Profile

Purity	LeadTime	CAS	PacketSize	UnitPrice
97%	<2 Days	588702-62-9		$54.54-$288.77$54.54$82.35$288.77