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220223-46-1

220223-46-1 | 1-tert-Butyl 4-methyl 3-oxopiperidine-1,4-dicarboxylate

CAS No: 220223-46-1 Catalog No: AG003S18 MDL No:MFCD12198882

Product Description

Catalog Number:
AG003S18
Chemical Name:
1-tert-Butyl 4-methyl 3-oxopiperidine-1,4-dicarboxylate
CAS Number:
220223-46-1
Molecular Formula:
C12H19NO5
Molecular Weight:
257.2830
MDL Number:
MFCD12198882
IUPAC Name:
1-O-tert-butyl 4-O-methyl 3-oxopiperidine-1,4-dicarboxylate
InChI:
InChI=1S/C12H19NO5/c1-12(2,3)18-11(16)13-6-5-8(9(14)7-13)10(15)17-4/h8H,5-7H2,1-4H3
InChI Key:
MVZLAUYYGDJPEA-UHFFFAOYSA-N
SMILES:
COC(=O)C1CCN(CC1=O)C(=O)OC(C)(C)C

Properties

Complexity:
358  
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1  
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
257.126g/mol
Formal Charge:
0
Heavy Atom Count:
18  
Hydrogen Bond Acceptor Count:
5  
Hydrogen Bond Donor Count:
0
Isotope Atom Count:
0
Molecular Weight:
257.286g/mol
Monoisotopic Mass:
257.126g/mol
Rotatable Bond Count:
4  
Topological Polar Surface Area:
72.9A^2
Undefined Atom Stereocenter Count:
1  
Undefined Bond Stereocenter Count:
0
XLogP3:
1.1  

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