Name: Name:3-amino-4-(2,2,2-trifluoroethoxy)benzoic acid
Brand: Angene
SKU: AG01AGMD
Rating: 90 (10 reviews)

3-amino-4-(2,2,2-trifluoroethoxy)benzoic acid

CAS No.:

1183675-62-8

Catalog Number:

AG01AGMD

Molecular Formula:

C9H8F3NO3

Molecular Weight:

235.1599

Catalog Number:

AG01AGMD

Chemical Name:

3-amino-4-(2,2,2-trifluoroethoxy)benzoic acid

CAS Number:

1183675-62-8

Molecular Formula:

C9H8F3NO3

Molecular Weight:

235.1599

MDL Number:

MFCD12812056

IUPAC Name:

3-amino-4-(2,2,2-trifluoroethoxy)benzoic acid

InChI:

InChI=1S/C9H8F3NO3/c10-9(11,12)4-16-7-2-1-5(8(14)15)3-6(7)13/h1-3H,4,13H2,(H,14,15)

InChI Key:

VUNBQAMLJWERBW-UHFFFAOYSA-N

SMILES:

Nc1cc(ccc1OCC(F)(F)F)C(=O)O

Complexity:

257

Compound Is Canonicalized:

Yes

Covalently-Bonded Unit Count:

Defined Atom Stereocenter Count:

Defined Bond Stereocenter Count:

Exact Mass:

235.046g/mol

Formal Charge:

Heavy Atom Count:

Hydrogen Bond Acceptor Count:

Hydrogen Bond Donor Count:

Isotope Atom Count:

Molecular Weight:

235.162g/mol

Monoisotopic Mass:

235.046g/mol

Rotatable Bond Count:

Topological Polar Surface Area:

72.6A^2

Undefined Atom Stereocenter Count:

Undefined Bond Stereocenter Count:

XLogP3:

2.1