Pentanedioic acid, 2-isocyanato-, diethyl ester, (S)-


Chemical Name: Pentanedioic acid, 2-isocyanato-, diethyl ester, (S)-
CAS Number: 145080-95-1
Product Number: AG001KJF(AGN-PC-0O30SO)
Synonyms:
MDL No:
Molecular Formula: C10H15NO5
Molecular Weight: 229.2298

Identification/Properties


Properties
BP:
151 °C / 10mmHg
Storage:
Room Temperature;
Form:
Liquid
Refractive Index:
-43.5 ° (C=neat)
Computed Properties
Molecular Weight:
229.232g/mol
XLogP3:
2
Hydrogen Bond Donor Count:
0
Hydrogen Bond Acceptor Count:
6
Rotatable Bond Count:
9
Exact Mass:
229.095g/mol
Monoisotopic Mass:
229.095g/mol
Topological Polar Surface Area:
82A^2
Heavy Atom Count:
16
Formal Charge:
0
Complexity:
283
Isotope Atom Count:
0
Defined Atom Stereocenter Count:
1
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:
N/A
Signal Word:
UN#:
-
Hazard Statements:
-
Precautionary Statements:
Class:
-
Packing Group:
-

NMR Spectrum


Other Analytical Data


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