Pentanedioic acid, monoethyl ester


Chemical Name: Pentanedioic acid, monoethyl ester
CAS Number: 1070-62-8
Product Number: AG003QFA(AGN-PC-03I8S1)
Synonyms:
MDL No:
Molecular Formula: C7H12O4
Molecular Weight: 160.1678

Identification/Properties


Properties
BP:
280°C at 760 mmHg
Storage:
Keep in dry area;Room Temperature;
Form:
Liquid
Refractive Index:
1.4365
Computed Properties
Molecular Weight:
160.169g/mol
XLogP3:
0.3
Hydrogen Bond Donor Count:
1
Hydrogen Bond Acceptor Count:
4
Rotatable Bond Count:
6
Exact Mass:
160.074g/mol
Monoisotopic Mass:
160.074g/mol
Topological Polar Surface Area:
63.6A^2
Heavy Atom Count:
11
Formal Charge:
0
Complexity:
141
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
Precautionary Statements:
P305+P351+P338
Class:
N/A
Packing Group:
N/A

NMR Spectrum


Other Analytical Data


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Chemical Structure



In chemical synthesis, 5-Ethoxy-5-oxopentanoic acid serves as a versatile building block for the production of various organic compounds. This compound can be used as a key intermediate in the synthesis of pharmaceuticals, agrochemicals, and specialty chemicals due to its unique structural properties. 5-Ethoxy-5-oxopentanoic acid can participate in different chemical reactions such as esterification, condensation, and substitution, allowing for the creation of complex molecules with specific functionalities. Its ethoxy and oxo groups provide opportunities for further modification and derivatization, making it a valuable tool in organic synthesis strategies. By incorporating 5-Ethoxy-5-oxopentanoic acid into synthetic pathways, chemists can access a diverse array of compounds with tailored properties and applications.