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1146894-86-1 | 1,3-Piperidinedicarboxylic acid, 1,3-diethyl ester
CAS No: 1146894-86-1 Catalog No: AG000F14 MDL No:MFCD09752687
Product Description
Catalog Number:
AG000F14
Chemical Name:
1,3-Piperidinedicarboxylic acid, 1,3-diethyl ester
CAS Number:
1146894-86-1
Molecular Formula:
C11H19NO4
Molecular Weight:
229.2729
MDL Number:
MFCD09752687
IUPAC Name:
diethyl piperidine-1,3-dicarboxylate
InChI:
InChI=1S/C11H19NO4/c1-3-15-10(13)9-6-5-7-12(8-9)11(14)16-4-2/h9H,3-8H2,1-2H3
InChI Key:
DJOSOUCNZVECLR-UHFFFAOYSA-N
SMILES:
CCOC(=O)C1CCCN(C1)C(=O)OCC
Properties
Complexity:
254
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
229.131g/mol
Formal Charge:
0
Heavy Atom Count:
16
Hydrogen Bond Acceptor Count:
4
Hydrogen Bond Donor Count:
0
Isotope Atom Count:
0
Molecular Weight:
229.276g/mol
Monoisotopic Mass:
229.131g/mol
Rotatable Bond Count:
5
Topological Polar Surface Area:
55.8A^2
Undefined Atom Stereocenter Count:
1
Undefined Bond Stereocenter Count:
0
XLogP3:
1.2
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