tert-butyl 3-oxo-1,4-diazepane-1-carboxylate


Chemical Name: tert-butyl 3-oxo-1,4-diazepane-1-carboxylate
CAS Number: 179686-38-5
Product Number: AG00277B(AGN-PC-03ICU6)
Synonyms:
MDL No: MFCD11975719
Molecular Formula: C10H18N2O3
Molecular Weight: 214.2615

Identification/Properties


Properties
BP:
373.1°C at 760 mmHg
Storage:
Keep in dry area;Room Temperature;
Form:
Solid
Computed Properties
Molecular Weight:
214.265g/mol
XLogP3:
0.6
Hydrogen Bond Donor Count:
1
Hydrogen Bond Acceptor Count:
3
Rotatable Bond Count:
2
Exact Mass:
214.132g/mol
Monoisotopic Mass:
214.132g/mol
Topological Polar Surface Area:
58.6A^2
Heavy Atom Count:
15
Formal Charge:
0
Complexity:
258
Isotope Atom Count:
0
Defined Atom Stereocenter Count:
0
Undefined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
Covalently-Bonded Unit Count:
1
Compound Is Canonicalized:
Yes

Safety Information


NMR Spectrum


Other Analytical Data


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