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210223-01-1 | 3-Piperidinepropanoic acid, 1-[(1,1-dimethylethoxy)carbonyl]-, ethyl ester, (3R)-
CAS No: 210223-01-1 Catalog No: AG002KN4 MDL No:
Product Description
Catalog Number:
AG002KN4
Chemical Name:
3-Piperidinepropanoic acid, 1-[(1,1-dimethylethoxy)carbonyl]-, ethyl ester, (3R)-
CAS Number:
210223-01-1
Molecular Formula:
C15H27NO4
Molecular Weight:
285.3792
IUPAC Name:
tert-butyl 3-(3-ethoxy-3-oxopropyl)piperidine-1-carboxylate
InChI:
InChI=1S/C15H27NO4/c1-5-19-13(17)9-8-12-7-6-10-16(11-12)14(18)20-15(2,3)4/h12H,5-11H2,1-4H3
InChI Key:
ZPJWRASPBMSPLW-UHFFFAOYSA-N
SMILES:
CCOC(=O)CC[C@H]1CCCN(C1)C(=O)OC(C)(C)C
Properties
Complexity:
335
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
285.194g/mol
Formal Charge:
0
Heavy Atom Count:
20
Hydrogen Bond Acceptor Count:
4
Hydrogen Bond Donor Count:
0
Isotope Atom Count:
0
Molecular Weight:
285.384g/mol
Monoisotopic Mass:
285.194g/mol
Rotatable Bond Count:
7
Topological Polar Surface Area:
55.8A^2
Undefined Atom Stereocenter Count:
1
Undefined Bond Stereocenter Count:
0
XLogP3:
2.4
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