2-Azetidinecarboxylic acid, 4-oxo-, phenylmethyl ester, (2S)-


Chemical Name: 2-Azetidinecarboxylic acid, 4-oxo-, phenylmethyl ester, (2S)-
CAS Number: 72776-05-7
Product Number: AG003CMX(AGN-PC-0OH6CX)
Synonyms:
MDL No:
Molecular Formula: C11H11NO3
Molecular Weight: 205.2099

Identification/Properties


Properties
MP:
137-140 °C(lit.)
BP:
404.7°C at 760 mmHg
Storage:
Keep in dry area;2-8℃;
Form:
Solid
Computed Properties
Molecular Weight:
205.213g/mol
XLogP3:
0.7
Hydrogen Bond Donor Count:
1
Hydrogen Bond Acceptor Count:
3
Rotatable Bond Count:
4
Exact Mass:
205.074g/mol
Monoisotopic Mass:
205.074g/mol
Topological Polar Surface Area:
55.4A^2
Heavy Atom Count:
15
Formal Charge:
0
Complexity:
259
Isotope Atom Count:
0
Defined Atom Stereocenter Count:
1
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:
P280-P305+P351+P338
Class:
N/A
Packing Group:
N/A

NMR Spectrum


Other Analytical Data


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