Name: Name:N-[(3-amino-5-fluorophenyl)methyl]-2,2,2-trifluoroacetamide
Brand: Angene
SKU: AG01C05X
Rating: 90 (10 reviews)

N-[(3-amino-5-fluorophenyl)methyl]-2,2,2-trifluoroacetamide

CAS No.:

2059949-79-8

Catalog Number:

AG01C05X

Molecular Formula:

C9H8F4N2O

Molecular Weight:

236.1662

Catalog Number:

AG01C05X

Chemical Name:

N-[(3-amino-5-fluorophenyl)methyl]-2,2,2-trifluoroacetamide

CAS Number:

2059949-79-8

Molecular Formula:

C9H8F4N2O

Molecular Weight:

236.1662

MDL Number:

MFCD30497837

IUPAC Name:

N-[(3-amino-5-fluorophenyl)methyl]-2,2,2-trifluoroacetamide

InChI:

InChI=1S/C9H8F4N2O/c10-6-1-5(2-7(14)3-6)4-15-8(16)9(11,12)13/h1-3H,4,14H2,(H,15,16)

InChI Key:

YNRQDVJBFJKWIA-UHFFFAOYSA-N

SMILES:

Nc1cc(CNC(=O)C(F)(F)F)cc(c1)F

Complexity:

256

Compound Is Canonicalized:

Yes

Covalently-Bonded Unit Count:

Defined Atom Stereocenter Count:

Defined Bond Stereocenter Count:

Exact Mass:

236.057g/mol

Formal Charge:

Heavy Atom Count:

Hydrogen Bond Acceptor Count:

Hydrogen Bond Donor Count:

Isotope Atom Count:

Molecular Weight:

236.17g/mol

Monoisotopic Mass:

236.057g/mol

Rotatable Bond Count:

Topological Polar Surface Area:

55.1A^2

Undefined Atom Stereocenter Count:

Undefined Bond Stereocenter Count:

XLogP3:

1.6