Name: Name:1-[3-(trifluoromethyl)pyridin-2-yl]piperidine-3-carboxylic acid
Brand: Angene
SKU: AG019U88
Rating: 90 (10 reviews)

1-[3-(trifluoromethyl)pyridin-2-yl]piperidine-3-carboxylic acid

CAS No.:

874772-68-6

Catalog Number:

AG019U88

Molecular Formula:

C12H13F3N2O2

Molecular Weight:

274.2390

Catalog Number:

AG019U88

Chemical Name:

1-[3-(trifluoromethyl)pyridin-2-yl]piperidine-3-carboxylic acid

CAS Number:

874772-68-6

Molecular Formula:

C12H13F3N2O2

Molecular Weight:

274.2390

MDL Number:

MFCD02091543

IUPAC Name:

1-[3-(trifluoromethyl)pyridin-2-yl]piperidine-3-carboxylic acid

InChI:

InChI=1S/C12H13F3N2O2/c13-12(14,15)9-4-1-5-16-10(9)17-6-2-3-8(7-17)11(18)19/h1,4-5,8H,2-3,6-7H2,(H,18,19)

InChI Key:

ZLGAIZATGMSSMM-UHFFFAOYSA-N

SMILES:

OC(=O)C1CCCN(C1)c1ncccc1C(F)(F)F

Complexity:

335

Compound Is Canonicalized:

Yes

Covalently-Bonded Unit Count:

Defined Atom Stereocenter Count:

Defined Bond Stereocenter Count:

Exact Mass:

274.093g/mol

Formal Charge:

Heavy Atom Count:

Hydrogen Bond Acceptor Count:

Hydrogen Bond Donor Count:

Isotope Atom Count:

Molecular Weight:

274.243g/mol

Monoisotopic Mass:

274.093g/mol

Rotatable Bond Count:

Topological Polar Surface Area:

53.4A^2

Undefined Atom Stereocenter Count:

Undefined Bond Stereocenter Count:

XLogP3:

2.2