200,000+ products from a single source!
sales@angenechem.com
Home > Carboxes > 1016709-97-9
1016709-97-9 | 4-Piperidinecarboxylic acid, 1-[(2,3-dihydro-1,4-benzodioxin-2-yl)carbonyl]-
CAS No: 1016709-97-9 Catalog No: AG00055F MDL No:
Product Description
Catalog Number:
AG00055F
Chemical Name:
4-Piperidinecarboxylic acid, 1-[(2,3-dihydro-1,4-benzodioxin-2-yl)carbonyl]-
CAS Number:
1016709-97-9
Molecular Formula:
C15H17NO5
Molecular Weight:
291.2992
IUPAC Name:
1-(2,3-dihydro-1,4-benzodioxine-3-carbonyl)piperidine-4-carboxylic acid
InChI:
InChI=1S/C15H17NO5/c17-14(16-7-5-10(6-8-16)15(18)19)13-9-20-11-3-1-2-4-12(11)21-13/h1-4,10,13H,5-9H2,(H,18,19)
InChI Key:
JTWBHAYZYFGQRB-UHFFFAOYSA-N
SMILES:
OC(=O)C1CCN(CC1)C(=O)C1COc2c(O1)cccc2
Properties
Complexity:
405
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
291.111g/mol
Formal Charge:
0
Heavy Atom Count:
21
Hydrogen Bond Acceptor Count:
5
Hydrogen Bond Donor Count:
1
Isotope Atom Count:
0
Molecular Weight:
291.303g/mol
Monoisotopic Mass:
291.111g/mol
Rotatable Bond Count:
2
Topological Polar Surface Area:
76.1A^2
Undefined Atom Stereocenter Count:
1
Undefined Bond Stereocenter Count:
0
XLogP3:
1.4
Related Products
Featured Products
© 2019 Angene International Limited. All rights Reserved.