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204452-21-1 | 1,3-Imidazolidinedicarboxylic acid, 2-oxo-, 1,3-bis(1,1-dimethylethyl) ester
CAS No: 204452-21-1 Catalog No: AG0029HW MDL No:
Product Description
Catalog Number:
AG0029HW
Chemical Name:
1,3-Imidazolidinedicarboxylic acid, 2-oxo-, 1,3-bis(1,1-dimethylethyl) ester
CAS Number:
204452-21-1
Molecular Formula:
C13H22N2O5
Molecular Weight:
286.3242
IUPAC Name:
ditert-butyl 2-oxoimidazolidine-1,3-dicarboxylate
InChI:
InChI=1S/C13H22N2O5/c1-12(2,3)19-10(17)14-7-8-15(9(14)16)11(18)20-13(4,5)6/h7-8H2,1-6H3
InChI Key:
GTKMTFLQZQJZOK-UHFFFAOYSA-N
SMILES:
O=C(N1CCN(C1=O)C(=O)OC(C)(C)C)OC(C)(C)C
Properties
Complexity:
382
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
286.153g/mol
Formal Charge:
0
Heavy Atom Count:
20
Hydrogen Bond Acceptor Count:
5
Hydrogen Bond Donor Count:
0
Isotope Atom Count:
0
Molecular Weight:
286.328g/mol
Monoisotopic Mass:
286.153g/mol
Rotatable Bond Count:
4
Topological Polar Surface Area:
76.2A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
1.8
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