Name: Name:4-{[(2,2,2-trifluoroethoxy)carbonyl]amino}benzoic acid
Brand: Angene
SKU: AG019SHO
Rating: 90 (10 reviews)

4-{[(2,2,2-trifluoroethoxy)carbonyl]amino}benzoic acid

CAS No.:

1307286-32-3

Catalog Number:

AG019SHO

Molecular Formula:

C10H8F3NO4

Molecular Weight:

263.1700

Catalog Number:

AG019SHO

Chemical Name:

4-{[(2,2,2-trifluoroethoxy)carbonyl]amino}benzoic acid

CAS Number:

1307286-32-3

Molecular Formula:

C10H8F3NO4

Molecular Weight:

263.1700

MDL Number:

MFCD13217752

IUPAC Name:

4-(2,2,2-trifluoroethoxycarbonylamino)benzoic acid

InChI:

InChI=1S/C10H8F3NO4/c11-10(12,13)5-18-9(17)14-7-3-1-6(2-4-7)8(15)16/h1-4H,5H2,(H,14,17)(H,15,16)

InChI Key:

HDORBKGPEBLZMQ-UHFFFAOYSA-N

SMILES:

O=C(Nc1ccc(cc1)C(=O)O)OCC(F)(F)F

Complexity:

311

Compound Is Canonicalized:

Yes

Covalently-Bonded Unit Count:

Defined Atom Stereocenter Count:

Defined Bond Stereocenter Count:

Exact Mass:

263.041g/mol

Formal Charge:

Heavy Atom Count:

Hydrogen Bond Acceptor Count:

Hydrogen Bond Donor Count:

Isotope Atom Count:

Molecular Weight:

263.172g/mol

Monoisotopic Mass:

263.041g/mol

Rotatable Bond Count:

Topological Polar Surface Area:

75.6A^2

Undefined Atom Stereocenter Count:

Undefined Bond Stereocenter Count:

XLogP3:

2.8