Butanedioic acid, hydroxy-, dimethyl ester, (2S)-


Chemical Name: Butanedioic acid, hydroxy-, dimethyl ester, (2S)-
CAS Number: 617-55-0
Product Number: AG003R6E(AGN-PC-0ODH59)
Synonyms:
MDL No:
Molecular Formula: C6H10O5
Molecular Weight: 162.1406

Identification/Properties


Properties
BP:
249.6°C at 760 mmHg
Storage:
Keep in dry area;Room Temperature;
Form:
Liquid
Refractive Index:
n20/D 1.441
Computed Properties
Molecular Weight:
162.141g/mol
XLogP3:
-0.7
Hydrogen Bond Donor Count:
1
Hydrogen Bond Acceptor Count:
5
Rotatable Bond Count:
5
Exact Mass:
162.053g/mol
Monoisotopic Mass:
162.053g/mol
Topological Polar Surface Area:
72.8A^2
Heavy Atom Count:
11
Formal Charge:
0
Complexity:
153
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:
Signal Word:
Danger
UN#:
1993
Hazard Statements:
H226-H317-H318
Precautionary Statements:
P210-P280-P305+P351+P338+P310-P333+P313-P403+P235
Class:
3
Packing Group:

NMR Spectrum


Other Analytical Data


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