200,000+ products from a single source!
sales@angenechem.com
Home > Carboxes > 1260773-00-9
1260773-00-9 | 1-Piperidinecarboxylic acid, 2-butyl-4-oxo-, phenylmethyl ester
CAS No: 1260773-00-9 Catalog No: AG000R7I MDL No:
Product Description
Catalog Number:
AG000R7I
Chemical Name:
1-Piperidinecarboxylic acid, 2-butyl-4-oxo-, phenylmethyl ester
CAS Number:
1260773-00-9
Molecular Formula:
C17H23NO3
Molecular Weight:
289.3694
IUPAC Name:
benzyl 2-butyl-4-oxopiperidine-1-carboxylate
InChI:
InChI=1S/C17H23NO3/c1-2-3-9-15-12-16(19)10-11-18(15)17(20)21-13-14-7-5-4-6-8-14/h4-8,15H,2-3,9-13H2,1H3
InChI Key:
MSZPRILFLGSJTA-UHFFFAOYSA-N
SMILES:
CCCCC1CC(=O)CCN1C(=O)OCc1ccccc1
Properties
Complexity:
350
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
289.168g/mol
Formal Charge:
0
Heavy Atom Count:
21
Hydrogen Bond Acceptor Count:
3
Hydrogen Bond Donor Count:
0
Isotope Atom Count:
0
Molecular Weight:
289.375g/mol
Monoisotopic Mass:
289.168g/mol
Rotatable Bond Count:
6
Topological Polar Surface Area:
46.6A^2
Undefined Atom Stereocenter Count:
1
Undefined Bond Stereocenter Count:
0
XLogP3:
2.9
Related Products
Featured Products
© 2019 Angene International Limited. All rights Reserved.