Name: Name:(S)-tert-butyl 3-(((4-bromophenyl)sulfonyl)oxy)piperidine-1-carboxylate
Brand: Angene
SKU: AG01CCUZ
Rating: 90 (10 reviews)

(S)-tert-butyl 3-(((4-bromophenyl)sulfonyl)oxy)piperidine-1-carboxylate

CAS No.:

2070009-69-5

Catalog Number:

AG01CCUZ

Molecular Formula:

C16H22BrNO5S

Molecular Weight:

420.3186

Catalog Number:

AG01CCUZ

Chemical Name:

(S)-tert-butyl 3-(((4-bromophenyl)sulfonyl)oxy)piperidine-1-carboxylate

CAS Number:

2070009-69-5

Molecular Formula:

C16H22BrNO5S

Molecular Weight:

420.3186

MDL Number:

MFCD28347561

IUPAC Name:

tert-butyl 3-(4-bromophenyl)sulfonyloxypiperidine-1-carboxylate

InChI:

InChI=1S/C16H22BrNO5S/c1-16(2,3)22-15(19)18-10-4-5-13(11-18)23-24(20,21)14-8-6-12(17)7-9-14/h6-9,13H,4-5,10-11H2,1-3H3

InChI Key:

AKXKTTULFLYCFH-UHFFFAOYSA-N

SMILES:

Brc1ccc(cc1)S(=O)(=O)O[C@H]1CCCN(C1)C(=O)OC(C)(C)C

Complexity:

532

Compound Is Canonicalized:

Yes

Covalently-Bonded Unit Count:

Defined Atom Stereocenter Count:

Defined Bond Stereocenter Count:

Exact Mass:

419.04g/mol

Formal Charge:

Heavy Atom Count:

Hydrogen Bond Acceptor Count:

Hydrogen Bond Donor Count:

Isotope Atom Count:

Molecular Weight:

420.318g/mol

Monoisotopic Mass:

419.04g/mol

Rotatable Bond Count:

Topological Polar Surface Area:

81.3A^2

Undefined Atom Stereocenter Count:

Undefined Bond Stereocenter Count:

XLogP3:

3.3