Name: Name:2-[2-oxo-3-(trifluoromethyl)-1,2-dihydropyridin-1-yl]acetic acid
Brand: Angene
SKU: AG019L2A
Rating: 90 (10 reviews)

2-[2-oxo-3-(trifluoromethyl)-1,2-dihydropyridin-1-yl]acetic acid

CAS No.:

950114-48-4

Catalog Number:

AG019L2A

Molecular Formula:

C8H6F3NO3

Molecular Weight:

221.1333

Catalog Number:

AG019L2A

Chemical Name:

2-[2-oxo-3-(trifluoromethyl)-1,2-dihydropyridin-1-yl]acetic acid

CAS Number:

950114-48-4

Molecular Formula:

C8H6F3NO3

Molecular Weight:

221.1333

MDL Number:

MFCD09802176

IUPAC Name:

2-[2-oxo-3-(trifluoromethyl)pyridin-1-yl]acetic acid

InChI:

InChI=1S/C8H6F3NO3/c9-8(10,11)5-2-1-3-12(7(5)15)4-6(13)14/h1-3H,4H2,(H,13,14)

InChI Key:

ZVHPCXBCBRHSGW-UHFFFAOYSA-N

SMILES:

OC(=O)Cn1cccc(c1=O)C(F)(F)F

Complexity:

357

Compound Is Canonicalized:

Yes

Covalently-Bonded Unit Count:

Defined Atom Stereocenter Count:

Defined Bond Stereocenter Count:

Exact Mass:

221.03g/mol

Formal Charge:

Heavy Atom Count:

Hydrogen Bond Acceptor Count:

Hydrogen Bond Donor Count:

Isotope Atom Count:

Molecular Weight:

221.135g/mol

Monoisotopic Mass:

221.03g/mol

Rotatable Bond Count:

Topological Polar Surface Area:

57.6A^2

Undefined Atom Stereocenter Count:

Undefined Bond Stereocenter Count:

XLogP3:

0.9