Name: Name:1-(3,5-dimethylbenzoyl)piperidine-2-carboxylic acid
Brand: Angene
SKU: AG01A3NA
Rating: 90 (10 reviews)

1-(3,5-dimethylbenzoyl)piperidine-2-carboxylic acid

CAS No.:

1101193-09-2

Catalog Number:

AG01A3NA

Molecular Formula:

C15H19NO3

Molecular Weight:

261.3163

Catalog Number:

AG01A3NA

Chemical Name:

1-(3,5-dimethylbenzoyl)piperidine-2-carboxylic acid

CAS Number:

1101193-09-2

Molecular Formula:

C15H19NO3

Molecular Weight:

261.3163

MDL Number:

MFCD09049183

IUPAC Name:

1-(3,5-dimethylbenzoyl)piperidine-2-carboxylic acid

InChI:

InChI=1S/C15H19NO3/c1-10-7-11(2)9-12(8-10)14(17)16-6-4-3-5-13(16)15(18)19/h7-9,13H,3-6H2,1-2H3,(H,18,19)

InChI Key:

SBKOERBWQZBUHY-UHFFFAOYSA-N

SMILES:

OC(=O)C1CCCCN1C(=O)c1cc(C)cc(c1)C

Complexity:

345

Compound Is Canonicalized:

Yes

Covalently-Bonded Unit Count:

Defined Atom Stereocenter Count:

Defined Bond Stereocenter Count:

Exact Mass:

261.136g/mol

Formal Charge:

Heavy Atom Count:

Hydrogen Bond Acceptor Count:

Hydrogen Bond Donor Count:

Isotope Atom Count:

Molecular Weight:

261.321g/mol

Monoisotopic Mass:

261.136g/mol

Rotatable Bond Count:

Topological Polar Surface Area:

57.6A^2

Undefined Atom Stereocenter Count:

Undefined Bond Stereocenter Count:

XLogP3:

2.6