Name: Name:tert-butyl 1-(2,2,2-trifluoroethyl)pyrrolidine-3-carboxylate
Brand: Angene
SKU: AG01BGAC
Rating: 90 (10 reviews)

tert-butyl 1-(2,2,2-trifluoroethyl)pyrrolidine-3-carboxylate

CAS No.:

1803608-99-2

Catalog Number:

AG01BGAC

Molecular Formula:

C11H18F3NO2

Molecular Weight:

253.2613

Catalog Number:

AG01BGAC

Chemical Name:

tert-butyl 1-(2,2,2-trifluoroethyl)pyrrolidine-3-carboxylate

CAS Number:

1803608-99-2

Molecular Formula:

C11H18F3NO2

Molecular Weight:

253.2613

MDL Number:

MFCD28125066

IUPAC Name:

tert-butyl 1-(2,2,2-trifluoroethyl)pyrrolidine-3-carboxylate

InChI:

InChI=1S/C11H18F3NO2/c1-10(2,3)17-9(16)8-4-5-15(6-8)7-11(12,13)14/h8H,4-7H2,1-3H3

InChI Key:

LTOQAOLLIKVIKG-UHFFFAOYSA-N

SMILES:

O=C(C1CCN(C1)CC(F)(F)F)OC(C)(C)C

Complexity:

283

Compound Is Canonicalized:

Yes

Covalently-Bonded Unit Count:

Defined Atom Stereocenter Count:

Defined Bond Stereocenter Count:

Exact Mass:

253.129g/mol

Formal Charge:

Heavy Atom Count:

Hydrogen Bond Acceptor Count:

Hydrogen Bond Donor Count:

Isotope Atom Count:

Molecular Weight:

253.265g/mol

Monoisotopic Mass:

253.129g/mol

Rotatable Bond Count:

Topological Polar Surface Area:

29.5A^2

Undefined Atom Stereocenter Count:

Undefined Bond Stereocenter Count:

XLogP3:

2.4