Methanediol, diacetate


Chemical Name: Methanediol, diacetate
CAS Number: 628-51-3
Product Number: AG0036WU(AGN-PC-0ODWIA)
Synonyms:
MDL No:
Molecular Formula: C5H8O4
Molecular Weight: 132.1146

Identification/Properties


Properties
MP:
−23 °C(lit.)
BP:
164.5°C at 760 mmHg
Storage:
Inert atmosphere;2-8℃;
Form:
Liquid
Refractive Index:
n20/D 1.405(lit.)
Computed Properties
Molecular Weight:
132.115g/mol
XLogP3:
0.1
Hydrogen Bond Donor Count:
0
Hydrogen Bond Acceptor Count:
4
Rotatable Bond Count:
4
Exact Mass:
132.042g/mol
Monoisotopic Mass:
132.042g/mol
Topological Polar Surface Area:
52.6A^2
Heavy Atom Count:
9
Formal Charge:
0
Complexity:
104
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


NMR Spectrum


Other Analytical Data


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