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tert-butyl N-{2-[(2-aminoethyl)amino]ethyl}carbamate

tert-butyl N-{2-[(2-aminoethyl)amino]ethyl}carbamate

CAS: 193206-49-4

Formula: C9H21N3O2

SMILES: CC(C)(C)OC(=O)NCCNCCN

IUPAC: tert-butyl N-{2-[(2-aminoethyl)amino]ethyl}carbamate

InChI: InChI=1S/C9H21N3O2/c1-9(2,3)14-8(13)12-7-6-11-5-4-10/h11H,4-7,10H2,1-3H3,(H,12,13)

Composition: C (53.18%), H (10.41%), N (20.67%), O (15.74%)

Molar Mass: 203.286

Atom Count: 35

Heavy Atom Count: 14

Properties
Properties
Common Names N/A
Aromatic Ring Count 0
Asymmetric Atom Count 0
Exact Mass 203.163376928
Formal Charge 0
FSP3 0.89
Hetero Ring Count 0
Hydrogen Bond Acceptor Count 3
Hydrogen Bond Donor Count 3
InChIKey KQXGYFNJIMVFDT-UHFFFAOYSA-N
Lipinski's Rule of Five 1
Molar Refractivity 55.47
Topological Polar Surface Area 76.38
Polarizability 22.27
Ring Count 0
Rotatable Bond Count 7

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