1-Azetidinecarboxylic acid, 3-(hydroxymethyl)-, 1,1-dimethylethyl ester


Chemical Name: 1-Azetidinecarboxylic acid, 3-(hydroxymethyl)-, 1,1-dimethylethyl ester
CAS Number: 142253-56-3
Product Number: AG001I2C(AGN-PC-0N70L2)
Synonyms:
MDL No: MFCD06656141
Molecular Formula: C9H17NO3
Molecular Weight: 187.2362

Identification/Properties


Properties
BP:
270.349 °C at 760 mmHg
Storage:
Keep in dry area;2-8℃;
Form:
Solid
Solubility:
Soluble in Dimethyl sulfoxide (DMSO).
Computed Properties
Molecular Weight:
187.239g/mol
XLogP3:
0.5
Hydrogen Bond Donor Count:
1
Hydrogen Bond Acceptor Count:
3
Rotatable Bond Count:
3
Exact Mass:
187.121g/mol
Monoisotopic Mass:
187.121g/mol
Topological Polar Surface Area:
49.8A^2
Heavy Atom Count:
13
Formal Charge:
0
Complexity:
192
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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