Name: Name:Butanoic acid, 3-[[(1,1-dimethylethoxy)carbonyl]amino]-4,4-difluoro-
Brand: Angene
SKU: AG008L13
Rating: 90 (10 reviews)

Butanoic acid, 3-[[(1,1-dimethylethoxy)carbonyl]amino]-4,4-difluoro-

CAS No.:

81982-56-1

Catalog Number:

AG008L13

Molecular Formula:

C9H15F2NO4

Molecular Weight:

239.2165

Catalog Number:

AG008L13

Chemical Name:

Butanoic acid, 3-[[(1,1-dimethylethoxy)carbonyl]amino]-4,4-difluoro-

CAS Number:

81982-56-1

Molecular Formula:

C9H15F2NO4

Molecular Weight:

239.2165

MDL Number:

MFCD27940624

IUPAC Name:

4,4-difluoro-3-[(2-methylpropan-2-yl)oxycarbonylamino]butanoic acid

InChI:

InChI=1S/C9H15F2NO4/c1-9(2,3)16-8(15)12-5(7(10)11)4-6(13)14/h5,7H,4H2,1-3H3,(H,12,15)(H,13,14)

InChI Key:

XHWAYUNOUVDRCD-UHFFFAOYSA-N

SMILES:

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

Complexity:

263

Compound Is Canonicalized:

Yes

Covalently-Bonded Unit Count:

Defined Atom Stereocenter Count:

Defined Bond Stereocenter Count:

Exact Mass:

239.097g/mol

Formal Charge:

Heavy Atom Count:

Hydrogen Bond Acceptor Count:

Hydrogen Bond Donor Count:

Isotope Atom Count:

Molecular Weight:

239.219g/mol

Monoisotopic Mass:

239.097g/mol

Rotatable Bond Count:

Topological Polar Surface Area:

75.6A^2

Undefined Atom Stereocenter Count:

Undefined Bond Stereocenter Count:

XLogP3:

1.3