Name: Name:1-[3-(trifluoromethoxy)benzenesulfonyl]piperidine-4-carboxylic acid
Brand: Angene
SKU: AG019L1D
Rating: 90 (10 reviews)

1-[3-(trifluoromethoxy)benzenesulfonyl]piperidine-4-carboxylic acid

CAS No.:

949791-66-6

Catalog Number:

AG019L1D

Molecular Formula:

C13H14F3NO5S

Molecular Weight:

353.3142

Catalog Number:

AG019L1D

Chemical Name:

1-[3-(trifluoromethoxy)benzenesulfonyl]piperidine-4-carboxylic acid

CAS Number:

949791-66-6

Molecular Formula:

C13H14F3NO5S

Molecular Weight:

353.3142

MDL Number:

MFCD09802154

IUPAC Name:

1-[3-(trifluoromethoxy)phenyl]sulfonylpiperidine-4-carboxylic acid

InChI:

InChI=1S/C13H14F3NO5S/c14-13(15,16)22-10-2-1-3-11(8-10)23(20,21)17-6-4-9(5-7-17)12(18)19/h1-3,8-9H,4-7H2,(H,18,19)

InChI Key:

KEUKFUPPTMOZGY-UHFFFAOYSA-N

SMILES:

OC(=O)C1CCN(CC1)S(=O)(=O)c1cccc(c1)OC(F)(F)F

Complexity:

523

Compound Is Canonicalized:

Yes

Covalently-Bonded Unit Count:

Defined Atom Stereocenter Count:

Defined Bond Stereocenter Count:

Exact Mass:

353.054g/mol

Formal Charge:

Heavy Atom Count:

Hydrogen Bond Acceptor Count:

Hydrogen Bond Donor Count:

Isotope Atom Count:

Molecular Weight:

353.312g/mol

Monoisotopic Mass:

353.054g/mol

Rotatable Bond Count:

Topological Polar Surface Area:

92.3A^2

Undefined Atom Stereocenter Count:

Undefined Bond Stereocenter Count:

XLogP3:

2.3