tert-Butyl 3-(2-ethoxy-2-oxoethylidene)azetidine-1-carboxylate


Chemical Name: tert-Butyl 3-(2-ethoxy-2-oxoethylidene)azetidine-1-carboxylate
CAS Number: 1002355-96-5
Product Number: AG0001BH(AGN-PC-0WAZNK)
Synonyms:
MDL No: MFCD16140210
Molecular Formula: C12H19NO4
Molecular Weight: 241.2836

Identification/Properties


Computed Properties
Molecular Weight:
241.287g/mol
XLogP3:
0.8
Hydrogen Bond Donor Count:
0
Hydrogen Bond Acceptor Count:
4
Rotatable Bond Count:
5
Exact Mass:
241.131g/mol
Monoisotopic Mass:
241.131g/mol
Topological Polar Surface Area:
55.8A^2
Heavy Atom Count:
17
Formal Charge:
0
Complexity:
333
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


GHS Pictogram:
Signal Word:
Warning
UN#:
N/A
Hazard Statements:
H302
Precautionary Statements:
P264-P270-P301+P312-P330
Class:
N/A
Packing Group:
N/A

NMR Spectrum


Other Analytical Data


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