Name: Name:1-{[2-(1-acetylpiperidin-2-yl)ethyl]sulfanyl}ethan-1-one
Brand: Angene
SKU: AG01BB7X
Rating: 90 (10 reviews)

1-{[2-(1-acetylpiperidin-2-yl)ethyl]sulfanyl}ethan-1-one

CAS No.:

1820608-89-6

Catalog Number:

AG01BB7X

Molecular Formula:

C11H19NO2S

Molecular Weight:

229.3391

Catalog Number:

AG01BB7X

Chemical Name:

1-{[2-(1-acetylpiperidin-2-yl)ethyl]sulfanyl}ethan-1-one

CAS Number:

1820608-89-6

Molecular Formula:

C11H19NO2S

Molecular Weight:

229.3391

MDL Number:

MFCD29033777

IUPAC Name:

S-[2-(1-acetylpiperidin-2-yl)ethyl] ethanethioate

InChI:

InChI=1S/C11H19NO2S/c1-9(13)12-7-4-3-5-11(12)6-8-15-10(2)14/h11H,3-8H2,1-2H3

InChI Key:

GOPQOVWBOBOLSX-UHFFFAOYSA-N

SMILES:

CC(=O)SCCC1CCCCN1C(=O)C

Complexity:

243

Compound Is Canonicalized:

Yes

Covalently-Bonded Unit Count:

Defined Atom Stereocenter Count:

Defined Bond Stereocenter Count:

Exact Mass:

229.114g/mol

Formal Charge:

Heavy Atom Count:

Hydrogen Bond Acceptor Count:

Hydrogen Bond Donor Count:

Isotope Atom Count:

Molecular Weight:

229.338g/mol

Monoisotopic Mass:

229.114g/mol

Rotatable Bond Count:

Topological Polar Surface Area:

62.7A^2

Undefined Atom Stereocenter Count:

Undefined Bond Stereocenter Count:

XLogP3:

1.4