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tert-butyl N-{[(2-aminoethyl)carbamoyl]methoxy}carbamate

tert-butyl N-{[(2-aminoethyl)carbamoyl]methoxy}carbamate

CAS: 160818-51-9

Formula: C9H19N3O4

SMILES: CC(C)(C)OC(=O)NOCC(=O)NCCN

IUPAC: tert-butyl N-{[(2-aminoethyl)carbamoyl]methoxy}carbamate

InChI: InChI=1S/C9H19N3O4/c1-9(2,3)16-8(14)12-15-6-7(13)11-5-4-10/h4-6,10H2,1-3H3,(H,11,13)(H,12,14)

Composition: C (46.34%), H (8.21%), N (18.01%), O (27.43%)

Molar Mass: 233.268

Atom Count: 35

Heavy Atom Count: 16

Properties
Properties
Common Names N/A
Aromatic Ring Count 0
Asymmetric Atom Count 0
Exact Mass 233.137556104
Formal Charge 0
FSP3 0.78
Hetero Ring Count 0
Hydrogen Bond Acceptor Count 4
Hydrogen Bond Donor Count 3
InChIKey AKZPPBPGCWBGMX-UHFFFAOYSA-N
Lipinski's Rule of Five 1
Molar Refractivity 56.9
Topological Polar Surface Area 102.68
Polarizability 22.75
Ring Count 0
Rotatable Bond Count 7

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