Home Carbonyls tert-butyl N-(2-amino-3-{[(tert-butoxy)carbonyl]amino}propyl)carbamate

tert-butyl N-(2-amino-3-{[(tert-butoxy)carbonyl]amino}propyl)carbamate

CAS No.:
149876-86-8
Catalog Number:
AG01BC1T
Molecular Formula:
C13H27N3O4
Molecular Weight:
289.3712
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Product Description
Catalog Number:
AG01BC1T
Chemical Name:
tert-butyl N-(2-amino-3-{[(tert-butoxy)carbonyl]amino}propyl)carbamate
CAS Number:
149876-86-8
Molecular Formula:
C13H27N3O4
Molecular Weight:
289.3712
MDL Number:
MFCD24465597
IUPAC Name:
tert-butyl N-[2-amino-3-[(2-methylpropan-2-yl)oxycarbonylamino]propyl]carbamate
InChI:
InChI=1S/C13H27N3O4/c1-12(2,3)19-10(17)15-7-9(14)8-16-11(18)20-13(4,5)6/h9H,7-8,14H2,1-6H3,(H,15,17)(H,16,18)
InChI Key:
QYVFEFFJTQKDTK-UHFFFAOYSA-N
SMILES:
NC(CNC(=O)OC(C)(C)C)CNC(=O)OC(C)(C)C
Properties
Complexity:
300  
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1  
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
289.2g/mol
Formal Charge:
0
Heavy Atom Count:
20  
Hydrogen Bond Acceptor Count:
5  
Hydrogen Bond Donor Count:
3  
Isotope Atom Count:
0
Molecular Weight:
289.376g/mol
Monoisotopic Mass:
289.2g/mol
Rotatable Bond Count:
8  
Topological Polar Surface Area:
103A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
0.8  
Properties