Name: Name:1-Benzyl-1,2,3,6-tetrahydropyridine-4-carboxylic acid
Brand: Angene
SKU: AG003DZ7
Rating: 90 (10 reviews)

1-Benzyl-1,2,3,6-tetrahydropyridine-4-carboxylic acid

CAS No.:

79858-48-3

Catalog Number:

AG003DZ7

Molecular Formula:

C13H15NO2

Molecular Weight:

217.2637

Catalog Number:

AG003DZ7

Chemical Name:

1-Benzyl-1,2,3,6-tetrahydropyridine-4-carboxylic acid

CAS Number:

79858-48-3

Molecular Formula:

C13H15NO2

Molecular Weight:

217.2637

MDL Number:

MFCD11100769

IUPAC Name:

1-benzyl-3,6-dihydro-2H-pyridine-4-carboxylic acid

InChI:

InChI=1S/C13H15NO2/c15-13(16)12-6-8-14(9-7-12)10-11-4-2-1-3-5-11/h1-6H,7-10H2,(H,15,16)

InChI Key:

OPFAYLIVQXUGBL-UHFFFAOYSA-N

SMILES:

OC(=O)C1=CCN(CC1)Cc1ccccc1

Complexity:

280

Compound Is Canonicalized:

Yes

Covalently-Bonded Unit Count:

Defined Atom Stereocenter Count:

Defined Bond Stereocenter Count:

Exact Mass:

217.11g/mol

Formal Charge:

Heavy Atom Count:

Hydrogen Bond Acceptor Count:

Hydrogen Bond Donor Count:

Isotope Atom Count:

Molecular Weight:

217.268g/mol

Monoisotopic Mass:

217.11g/mol

Rotatable Bond Count:

Topological Polar Surface Area:

40.5A^2

Undefined Atom Stereocenter Count:

Undefined Bond Stereocenter Count:

XLogP3:

-0.6