Pentanedioic acid, 3-hydroxy-, dimethyl ester


Chemical Name: Pentanedioic acid, 3-hydroxy-, dimethyl ester
CAS Number: 7250-55-7
Product Number: AG003PLC(AGN-PC-0JOA5N)
Synonyms:
MDL No:
Molecular Formula: C7H12O5
Molecular Weight: 176.1672

Identification/Properties


Properties
BP:
265.6°C at 760 mmHg
Storage:
Keep in dry area;Room Temperature;
Form:
Liquid
Refractive Index:
n20/D 1.442(lit.)
Computed Properties
Molecular Weight:
176.168g/mol
XLogP3:
-0.7
Hydrogen Bond Donor Count:
1
Hydrogen Bond Acceptor Count:
5
Rotatable Bond Count:
6
Exact Mass:
176.068g/mol
Monoisotopic Mass:
176.068g/mol
Topological Polar Surface Area:
72.8A^2
Heavy Atom Count:
12
Formal Charge:
0
Complexity:
147
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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