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194726-40-4 | (R);-1-tert-Butyl 3-ethyl piperidine-1,3-dicarboxylate
CAS No: 194726-40-4 Catalog No: AG003C8A MDL No:MFCD07374389
Product Description
Catalog Number:
AG003C8A
Chemical Name:
(R);-1-tert-Butyl 3-ethyl piperidine-1,3-dicarboxylate
CAS Number:
194726-40-4
Molecular Formula:
C13H23NO4
Molecular Weight:
257.3260
MDL Number:
MFCD07374389
IUPAC Name:
1-O-tert-butyl 3-O-ethyl (3R)-piperidine-1,3-dicarboxylate
InChI:
InChI=1S/C13H23NO4/c1-5-17-11(15)10-7-6-8-14(9-10)12(16)18-13(2,3)4/h10H,5-9H2,1-4H3/t10-/m1/s1
InChI Key:
YCXCRFGBFZTUSU-SNVBAGLBSA-N
SMILES:
CCOC(=O)[C@@H]1CCCN(C1)C(=O)OC(C)(C)C
Properties
Complexity:
309
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
1
Defined Bond Stereocenter Count:
0
Exact Mass:
257.163g/mol
Formal Charge:
0
Heavy Atom Count:
18
Hydrogen Bond Acceptor Count:
4
Hydrogen Bond Donor Count:
0
Isotope Atom Count:
0
Molecular Weight:
257.33g/mol
Monoisotopic Mass:
257.163g/mol
Rotatable Bond Count:
5
Topological Polar Surface Area:
55.8A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
1.8
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