Home Carboxys tert-butyl 2-tert-butyl-4-oxo-1,3-diazinane-1-carboxylate

tert-butyl 2-tert-butyl-4-oxo-1,3-diazinane-1-carboxylate

CAS No.:
220116-69-8
Catalog Number:
AG01B58X
Molecular Formula:
C13H24N2O3
Molecular Weight:
256.3413
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Product Description
Catalog Number:
AG01B58X
Chemical Name:
tert-butyl 2-tert-butyl-4-oxo-1,3-diazinane-1-carboxylate
CAS Number:
220116-69-8
Molecular Formula:
C13H24N2O3
Molecular Weight:
256.3413
MDL Number:
MFCD24474162
IUPAC Name:
tert-butyl 2-tert-butyl-4-oxo-1,3-diazinane-1-carboxylate
InChI:
InChI=1S/C13H24N2O3/c1-12(2,3)10-14-9(16)7-8-15(10)11(17)18-13(4,5)6/h10H,7-8H2,1-6H3,(H,14,16)
InChI Key:
AIZNAHFBIATZMP-UHFFFAOYSA-N
SMILES:
O=C(N1CCC(=O)NC1C(C)(C)C)OC(C)(C)C
Properties
Complexity:
339  
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1  
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
256.179g/mol
Formal Charge:
0
Heavy Atom Count:
18  
Hydrogen Bond Acceptor Count:
3  
Hydrogen Bond Donor Count:
1  
Isotope Atom Count:
0
Molecular Weight:
256.346g/mol
Monoisotopic Mass:
256.179g/mol
Rotatable Bond Count:
3  
Topological Polar Surface Area:
58.6A^2
Undefined Atom Stereocenter Count:
1  
Undefined Bond Stereocenter Count:
0
XLogP3:
2  
Properties