Name: Name:1-[(tert-butoxy)carbonyl]-4-(trifluoromethyl)pyrrolidine-2-carboxylic acid
Brand: Angene
SKU: AG01B484
Rating: 90 (10 reviews)

1-[(tert-butoxy)carbonyl]-4-(trifluoromethyl)pyrrolidine-2-carboxylic acid

CAS No.:

1822589-98-9

Catalog Number:

AG01B484

Molecular Formula:

C11H16F3NO4

Molecular Weight:

283.2442

Catalog Number:

AG01B484

Chemical Name:

1-[(tert-butoxy)carbonyl]-4-(trifluoromethyl)pyrrolidine-2-carboxylic acid

CAS Number:

1822589-98-9

Molecular Formula:

C11H16F3NO4

Molecular Weight:

283.2442

MDL Number:

MFCD24532045

IUPAC Name:

1-[(2-methylpropan-2-yl)oxycarbonyl]-4-(trifluoromethyl)pyrrolidine-2-carboxylic acid

InChI:

InChI=1S/C11H16F3NO4/c1-10(2,3)19-9(18)15-5-6(11(12,13)14)4-7(15)8(16)17/h6-7H,4-5H2,1-3H3,(H,16,17)

InChI Key:

OHIYKPXMNWXZQH-UHFFFAOYSA-N

SMILES:

OC(=O)C1CC(CN1C(=O)OC(C)(C)C)C(F)(F)F

Complexity:

375

Compound Is Canonicalized:

Yes

Covalently-Bonded Unit Count:

Defined Atom Stereocenter Count:

Defined Bond Stereocenter Count:

Exact Mass:

283.103g/mol

Formal Charge:

Heavy Atom Count:

Hydrogen Bond Acceptor Count:

Hydrogen Bond Donor Count:

Isotope Atom Count:

Molecular Weight:

283.247g/mol

Monoisotopic Mass:

283.103g/mol

Rotatable Bond Count:

Topological Polar Surface Area:

66.8A^2

Undefined Atom Stereocenter Count:

Undefined Bond Stereocenter Count:

XLogP3:

2.2