Name: Name:1-(5-chloro-1,2-benzoxazol-3-yl)piperidine-4-carboxylic acid
Brand: Angene
SKU: AG01AMAS
Rating: 90 (10 reviews)

1-(5-chloro-1,2-benzoxazol-3-yl)piperidine-4-carboxylic acid

CAS No.:

1820741-63-6

Catalog Number:

AG01AMAS

Molecular Formula:

C13H13ClN2O3

Molecular Weight:

280.7069

Catalog Number:

AG01AMAS

Chemical Name:

1-(5-chloro-1,2-benzoxazol-3-yl)piperidine-4-carboxylic acid

CAS Number:

1820741-63-6

Molecular Formula:

C13H13ClN2O3

Molecular Weight:

280.7069

MDL Number:

MFCD29033918

IUPAC Name:

1-(5-chloro-1,2-benzoxazol-3-yl)piperidine-4-carboxylic acid

InChI:

InChI=1S/C13H13ClN2O3/c14-9-1-2-11-10(7-9)12(15-19-11)16-5-3-8(4-6-16)13(17)18/h1-2,7-8H,3-6H2,(H,17,18)

InChI Key:

AMJWCNHBADVIAA-UHFFFAOYSA-N

SMILES:

OC(=O)C1CCN(CC1)c1noc2c1cc(Cl)cc2

Complexity:

347

Compound Is Canonicalized:

Yes

Covalently-Bonded Unit Count:

Defined Atom Stereocenter Count:

Defined Bond Stereocenter Count:

Exact Mass:

280.061g/mol

Formal Charge:

Heavy Atom Count:

Hydrogen Bond Acceptor Count:

Hydrogen Bond Donor Count:

Isotope Atom Count:

Molecular Weight:

280.708g/mol

Monoisotopic Mass:

280.061g/mol

Rotatable Bond Count:

Topological Polar Surface Area:

66.6A^2

Undefined Atom Stereocenter Count:

Undefined Bond Stereocenter Count:

XLogP3:

2.8