Butanedioic acid, methylene-, dibutyl ester


Chemical Name: Butanedioic acid, methylene-, dibutyl ester
CAS Number: 2155-60-4
Product Number: AG003PC9(AGN-PC-0JLP4E)
Synonyms:
MDL No:
Molecular Formula: C13H22O4
Molecular Weight: 242.3114

Identification/Properties


Properties
BP:
307.4°C at 760 mmHg
Form:
Liquid
Computed Properties
Molecular Weight:
242.315g/mol
XLogP3:
3
Hydrogen Bond Donor Count:
0
Hydrogen Bond Acceptor Count:
4
Rotatable Bond Count:
11
Exact Mass:
242.152g/mol
Monoisotopic Mass:
242.152g/mol
Topological Polar Surface Area:
52.6A^2
Heavy Atom Count:
17
Formal Charge:
0
Complexity:
258
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:
H319-H413
Precautionary Statements:
P305+P351+P338
Class:
N/A
Packing Group:
N/A

NMR Spectrum


Other Analytical Data


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