Name: Name:1-[(tert-butoxy)carbonyl]-4-methanesulfinylpiperidine-4-carboxylic acid
Brand: Angene
SKU: AG01AP2M
Rating: 90 (10 reviews)

1-[(tert-butoxy)carbonyl]-4-methanesulfinylpiperidine-4-carboxylic acid

CAS No.:

1864062-98-5

Catalog Number:

AG01AP2M

Molecular Formula:

C12H21NO5S

Molecular Weight:

291.3638

Catalog Number:

AG01AP2M

Chemical Name:

1-[(tert-butoxy)carbonyl]-4-methanesulfinylpiperidine-4-carboxylic acid

CAS Number:

1864062-98-5

Molecular Formula:

C12H21NO5S

Molecular Weight:

291.3638

MDL Number:

MFCD29034381

IUPAC Name:

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

InChI:

InChI=1S/C12H21NO5S/c1-11(2,3)18-10(16)13-7-5-12(6-8-13,9(14)15)19(4)17/h5-8H2,1-4H3,(H,14,15)

InChI Key:

NAFNGVKOYRJMIY-UHFFFAOYSA-N

SMILES:

O=C(N1CCC(CC1)(C(=O)O)S(=O)C)OC(C)(C)C

Complexity:

393

Compound Is Canonicalized:

Yes

Covalently-Bonded Unit Count:

Defined Atom Stereocenter Count:

Defined Bond Stereocenter Count:

Exact Mass:

291.114g/mol

Formal Charge:

Heavy Atom Count:

Hydrogen Bond Acceptor Count:

Hydrogen Bond Donor Count:

Isotope Atom Count:

Molecular Weight:

291.362g/mol

Monoisotopic Mass:

291.114g/mol

Rotatable Bond Count:

Topological Polar Surface Area:

103A^2

Undefined Atom Stereocenter Count:

Undefined Bond Stereocenter Count:

XLogP3:

0.3