Name: Name:tert-butyl 3-oxo-4-[4-(trifluoromethyl)phenyl]piperidine-1-carboxylate
Brand: Angene
SKU: AG019SQ4
Rating: 90 (10 reviews)

tert-butyl 3-oxo-4-[4-(trifluoromethyl)phenyl]piperidine-1-carboxylate

CAS No.:

1354953-32-4

Catalog Number:

AG019SQ4

Molecular Formula:

C17H20F3NO3

Molecular Weight:

343.3408

Catalog Number:

AG019SQ4

Chemical Name:

tert-butyl 3-oxo-4-[4-(trifluoromethyl)phenyl]piperidine-1-carboxylate

CAS Number:

1354953-32-4

Molecular Formula:

C17H20F3NO3

Molecular Weight:

343.3408

MDL Number:

MFCD20502197

IUPAC Name:

tert-butyl 3-oxo-4-[4-(trifluoromethyl)phenyl]piperidine-1-carboxylate

InChI:

InChI=1S/C17H20F3NO3/c1-16(2,3)24-15(23)21-9-8-13(14(22)10-21)11-4-6-12(7-5-11)17(18,19)20/h4-7,13H,8-10H2,1-3H3

InChI Key:

OBKZFRHLNRLHBO-UHFFFAOYSA-N

SMILES:

O=C1CN(CCC1c1ccc(cc1)C(F)(F)F)C(=O)OC(C)(C)C

Complexity:

477

Compound Is Canonicalized:

Yes

Covalently-Bonded Unit Count:

Defined Atom Stereocenter Count:

Defined Bond Stereocenter Count:

Exact Mass:

343.14g/mol

Formal Charge:

Heavy Atom Count:

Hydrogen Bond Acceptor Count:

Hydrogen Bond Donor Count:

Isotope Atom Count:

Molecular Weight:

343.346g/mol

Monoisotopic Mass:

343.14g/mol

Rotatable Bond Count:

Topological Polar Surface Area:

46.6A^2

Undefined Atom Stereocenter Count:

Undefined Bond Stereocenter Count:

XLogP3:

3.6