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1558-95-8 | Propanedioic acid, 2-[2-(1-piperidinyl)ethyl]-, 1,3-diethyl ester
CAS No: 1558-95-8 Catalog No: AG001O8G MDL No:
Product Description
Catalog Number:
AG001O8G
Chemical Name:
Propanedioic acid, 2-[2-(1-piperidinyl)ethyl]-, 1,3-diethyl ester
CAS Number:
1558-95-8
Molecular Formula:
C14H25NO4
Molecular Weight:
271.3526
IUPAC Name:
diethyl 2-(2-piperidin-1-ylethyl)propanedioate
InChI:
InChI=1S/C14H25NO4/c1-3-18-13(16)12(14(17)19-4-2)8-11-15-9-6-5-7-10-15/h12H,3-11H2,1-2H3
InChI Key:
ORINDJLLUXGPAB-UHFFFAOYSA-N
SMILES:
CCOC(=O)C(C(=O)OCC)CCN1CCCCC1
Properties
Complexity:
269
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
271.178g/mol
Formal Charge:
0
Heavy Atom Count:
19
Hydrogen Bond Acceptor Count:
5
Hydrogen Bond Donor Count:
0
Isotope Atom Count:
0
Molecular Weight:
271.357g/mol
Monoisotopic Mass:
271.178g/mol
Rotatable Bond Count:
9
Topological Polar Surface Area:
55.8A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
2.1
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