Name: Name:Butanoic acid, 2-(acetylamino)-4,4,4-trifluoro-
Brand: Angene
SKU: AG000QAO
Rating: 90 (10 reviews)

Butanoic acid, 2-(acetylamino)-4,4,4-trifluoro-

CAS No.:

120097-65-6

Catalog Number:

AG000QAO

Molecular Formula:

C6H8F3NO3

Molecular Weight:

199.1278

Catalog Number:

AG000QAO

Chemical Name:

Butanoic acid, 2-(acetylamino)-4,4,4-trifluoro-

CAS Number:

120097-65-6

Molecular Formula:

C6H8F3NO3

Molecular Weight:

199.1278

MDL Number:

MFCD19661012

IUPAC Name:

2-acetamido-4,4,4-trifluorobutanoic acid

InChI:

InChI=1S/C6H8F3NO3/c1-3(11)10-4(5(12)13)2-6(7,8)9/h4H,2H2,1H3,(H,10,11)(H,12,13)

InChI Key:

BCCRZHTXNJUSFS-UHFFFAOYSA-N

SMILES:

OC(=O)C(CC(F)(F)F)NC(=O)C

Complexity:

214

Compound Is Canonicalized:

Yes

Covalently-Bonded Unit Count:

Defined Atom Stereocenter Count:

Defined Bond Stereocenter Count:

Exact Mass:

199.046g/mol

Formal Charge:

Heavy Atom Count:

Hydrogen Bond Acceptor Count:

Hydrogen Bond Donor Count:

Isotope Atom Count:

Molecular Weight:

199.129g/mol

Monoisotopic Mass:

199.046g/mol

Rotatable Bond Count:

Topological Polar Surface Area:

66.4A^2

Undefined Atom Stereocenter Count:

Undefined Bond Stereocenter Count:

XLogP3:

0.6