3-Oxetanecarboxylic acid, 3-methyl-


Chemical Name: 3-Oxetanecarboxylic acid, 3-methyl-
CAS Number: 28562-68-7
Product Number: AG002VPJ(AGN-PC-0006FY)
Synonyms:
MDL No: MFCD09842435
Molecular Formula: C5H8O3
Molecular Weight: 116.1152

Identification/Properties


Properties
MP:
58-60℃
BP:
223.5°C at 760 mmHg
Storage:
Keep in dry area;-10 ℃;
Form:
Solid
Stability:
Moisture Sensitive
Computed Properties
Molecular Weight:
116.116g/mol
XLogP3:
-0.3
Hydrogen Bond Donor Count:
1
Hydrogen Bond Acceptor Count:
3
Rotatable Bond Count:
1
Exact Mass:
116.047g/mol
Monoisotopic Mass:
116.047g/mol
Topological Polar Surface Area:
46.5A^2
Heavy Atom Count:
8
Formal Charge:
0
Complexity:
115
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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