Butanoic acid, 2,3-dihydroxypropyl ester


Chemical Name: Butanoic acid, 2,3-dihydroxypropyl ester
CAS Number: 557-25-5
Product Number: AG003EJ4(AGN-PC-0JK9WY)
Synonyms:
MDL No:
Molecular Formula: C7H14O4
Molecular Weight: 162.1837

Identification/Properties


Properties
BP:
153 °C (7 mmHg)
Storage:
Room Temperature;
Form:
Liquid
Refractive Index:
1.445-1.453
Computed Properties
Molecular Weight:
162.185g/mol
XLogP3:
-0.2
Hydrogen Bond Donor Count:
2
Hydrogen Bond Acceptor Count:
4
Rotatable Bond Count:
6
Exact Mass:
162.089g/mol
Monoisotopic Mass:
162.089g/mol
Topological Polar Surface Area:
66.8A^2
Heavy Atom Count:
11
Formal Charge:
0
Complexity:
113
Isotope Atom Count:
0
Defined Atom Stereocenter Count:
0
Undefined Atom Stereocenter Count:
1
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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