Name: Name:1,3-Piperidinedicarboxylic acid, 3-ethyl-, 1-(phenylmethyl) ester
Brand: Angene
SKU: AG000MFF
Rating: 90 (10 reviews)

1,3-Piperidinedicarboxylic acid, 3-ethyl-, 1-(phenylmethyl) ester

CAS No.:

1245808-57-4

Catalog Number:

AG000MFF

Molecular Formula:

C16H20NO4-

Molecular Weight:

290.3343

Catalog Number:

AG000MFF

Chemical Name:

1,3-Piperidinedicarboxylic acid, 3-ethyl-, 1-(phenylmethyl) ester

CAS Number:

1245808-57-4

Molecular Formula:

C16H20NO4-

Molecular Weight:

290.3343

MDL Number:

MFCD17976788

IUPAC Name:

3-ethyl-1-phenylmethoxycarbonylpiperidine-3-carboxylic acid

InChI:

InChI=1S/C16H21NO4/c1-2-16(14(18)19)9-6-10-17(12-16)15(20)21-11-13-7-4-3-5-8-13/h3-5,7-8H,2,6,9-12H2,1H3,(H,18,19)

InChI Key:

UMJDUZFRWNBBGO-UHFFFAOYSA-N

SMILES:

CCC1(CCCN(C1)C(=O)OCc1ccccc1)C(=O)[O-]

Complexity:

379

Compound Is Canonicalized:

Yes

Covalently-Bonded Unit Count:

Defined Atom Stereocenter Count:

Defined Bond Stereocenter Count:

Exact Mass:

291.147g/mol

Formal Charge:

Heavy Atom Count:

Hydrogen Bond Acceptor Count:

Hydrogen Bond Donor Count:

Isotope Atom Count:

Molecular Weight:

291.347g/mol

Monoisotopic Mass:

291.147g/mol

Rotatable Bond Count:

Topological Polar Surface Area:

66.8A^2

Undefined Atom Stereocenter Count:

Undefined Bond Stereocenter Count:

XLogP3:

2.4