Propanoic acid, 3,3-diethoxy-, ethyl ester


Chemical Name: Propanoic acid, 3,3-diethoxy-, ethyl ester
CAS Number: 10601-80-6
Product Number: AG003616(AGN-PC-0JL75A)
Synonyms:
MDL No: MFCD00009865
Molecular Formula: C9H18O4
Molecular Weight: 190.2368

Identification/Properties


Properties
BP:
209.3°C at 760 mmHg
Storage:
Inert atmosphere;Room Temperature;
Form:
Liquid
Refractive Index:
n20/D 1.411(lit.)
Computed Properties
Molecular Weight:
190.239g/mol
XLogP3:
1
Hydrogen Bond Donor Count:
0
Hydrogen Bond Acceptor Count:
4
Rotatable Bond Count:
8
Exact Mass:
190.121g/mol
Monoisotopic Mass:
190.121g/mol
Topological Polar Surface Area:
44.8A^2
Heavy Atom Count:
13
Formal Charge:
0
Complexity:
130
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#:
-
Hazard Statements:
H315-H319-H335
Precautionary Statements:
P261-P305+P351+P338
Class:
-
Packing Group:
-

NMR Spectrum


Other Analytical Data


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