4,4-Dimethoxybutanoic Acid Methyl Ester


Chemical Name: 4,4-Dimethoxybutanoic Acid Methyl Ester
CAS Number: 4220-66-0
Product Number: AG0033UY(AGN-PC-0WAFWC)
Synonyms:
MDL No:
Molecular Formula: C7H14O4
Molecular Weight: 162.1837

Identification/Properties


Properties
BP:
191.8°C at 760 mmHg
Storage:
Inert atmosphere;2-8℃;
Form:
Liquid
Refractive Index:
n20/D 1.417(lit.)
Computed Properties
Molecular Weight:
162.185g/mol
XLogP3:
0.3
Hydrogen Bond Donor Count:
0
Hydrogen Bond Acceptor Count:
4
Rotatable Bond Count:
6
Exact Mass:
162.089g/mol
Monoisotopic Mass:
162.089g/mol
Topological Polar Surface Area:
44.8A^2
Heavy Atom Count:
11
Formal Charge:
0
Complexity:
109
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:
H302-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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