1-Azetidinecarboxylic acid, 3-(2-iodoethyl)-, 1,1-dimethylethyl ester


Chemical Name: 1-Azetidinecarboxylic acid, 3-(2-iodoethyl)-, 1,1-dimethylethyl ester
CAS Number: 158602-36-9
Product Number: AG001QCA(AGN-PC-025OFS)
Synonyms:
MDL No:
Molecular Formula: C10H18INO2
Molecular Weight: 311.1599

Identification/Properties


Computed Properties
Molecular Weight:
311.163g/mol
XLogP3:
2.8
Hydrogen Bond Donor Count:
0
Hydrogen Bond Acceptor Count:
2
Rotatable Bond Count:
4
Exact Mass:
311.038g/mol
Monoisotopic Mass:
311.038g/mol
Topological Polar Surface Area:
29.5A^2
Heavy Atom Count:
14
Formal Charge:
0
Complexity:
207
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:
H315-H319-H335
Precautionary Statements:
P261-P305+P351+P338
Class:
N/A
Packing Group:
N/A

NMR Spectrum


Other Analytical Data


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