200,000+ products from a single source!
sales@angenechem.com
139290-71-4 | 1-Piperidinecarboxylic acid, 4-(2,3-dimethoxybenzoyl)-, 1,1-dimethylethyl ester
CAS No: 139290-71-4 Catalog No: AG001AP0 MDL No:
Product Description
Catalog Number:
AG001AP0
Chemical Name:
1-Piperidinecarboxylic acid, 4-(2,3-dimethoxybenzoyl)-, 1,1-dimethylethyl ester
CAS Number:
139290-71-4
Molecular Formula:
C19H27NO5
Molecular Weight:
349.4214
IUPAC Name:
tert-butyl 4-(2,3-dimethoxybenzoyl)piperidine-1-carboxylate
InChI:
InChI=1S/C19H27NO5/c1-19(2,3)25-18(22)20-11-9-13(10-12-20)16(21)14-7-6-8-15(23-4)17(14)24-5/h6-8,13H,9-12H2,1-5H3
InChI Key:
ASGQPSLNQQAJOW-UHFFFAOYSA-N
SMILES:
COc1c(OC)cccc1C(=O)C1CCN(CC1)C(=O)OC(C)(C)C
Properties
Complexity:
465
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
349.189g/mol
Formal Charge:
0
Heavy Atom Count:
25
Hydrogen Bond Acceptor Count:
5
Hydrogen Bond Donor Count:
0
Isotope Atom Count:
0
Molecular Weight:
349.427g/mol
Monoisotopic Mass:
349.189g/mol
Rotatable Bond Count:
6
Topological Polar Surface Area:
65.1A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
2.9
Related Products
Featured Products
© 2019 Angene International Limited. All rights Reserved.