Name: Name:Benzeneacetic acid, α-[[(1,1-dimethylethoxy)carbonyl]amino]-2,4-difluoro-
Brand: Angene
SKU: AG0007OM
Rating: 90 (10 reviews)

Benzeneacetic acid, α-[[(1,1-dimethylethoxy)carbonyl]amino]-2,4-difluoro-

CAS No.:

1025496-16-5

Catalog Number:

AG0007OM

Molecular Formula:

C13H15F2NO4

Molecular Weight:

287.2593

Catalog Number:

AG0007OM

Chemical Name:

Benzeneacetic acid, α-[[(1,1-dimethylethoxy)carbonyl]amino]-2,4-difluoro-

CAS Number:

1025496-16-5

Molecular Formula:

C13H15F2NO4

Molecular Weight:

287.2593

MDL Number:

MFCD07388901

IUPAC Name:

2-(2,4-difluorophenyl)-2-[(2-methylpropan-2-yl)oxycarbonylamino]acetic acid

InChI:

InChI=1S/C13H15F2NO4/c1-13(2,3)20-12(19)16-10(11(17)18)8-5-4-7(14)6-9(8)15/h4-6,10H,1-3H3,(H,16,19)(H,17,18)

InChI Key:

CVINMJDGSGBHTL-UHFFFAOYSA-N

SMILES:

O=C(OC(C)(C)C)NC(c1ccc(cc1F)F)C(=O)O

Complexity:

370

Compound Is Canonicalized:

Yes

Covalently-Bonded Unit Count:

Defined Atom Stereocenter Count:

Defined Bond Stereocenter Count:

Exact Mass:

287.097g/mol

Formal Charge:

Heavy Atom Count:

Hydrogen Bond Acceptor Count:

Hydrogen Bond Donor Count:

Isotope Atom Count:

Molecular Weight:

287.263g/mol

Monoisotopic Mass:

287.097g/mol

Rotatable Bond Count:

Topological Polar Surface Area:

75.6A^2

Undefined Atom Stereocenter Count:

Undefined Bond Stereocenter Count:

XLogP3:

2.4