Butanedioic acid, 2,3-dimethyl-, (R*,S*)-


Chemical Name: Butanedioic acid, 2,3-dimethyl-, (R*,S*)-
CAS Number: 608-40-2
Product Number: AG00ECRO(AGN-PC-0OD6ZU)
Synonyms:
MDL No:
Molecular Formula: C6H10O4
Molecular Weight: 146.1412

Identification/Properties


Properties
MP:
200 °C (dec.)(lit.)
BP:
185.74°C (rough estimate)
Storage:
Room Temperature;
Form:
Solid
Refractive Index:
1.4310 (estimate)
Computed Properties
Molecular Weight:
146.142g/mol
XLogP3:
0.4
Hydrogen Bond Donor Count:
2
Hydrogen Bond Acceptor Count:
4
Rotatable Bond Count:
3
Exact Mass:
146.058g/mol
Monoisotopic Mass:
146.058g/mol
Topological Polar Surface Area:
74.6A^2
Heavy Atom Count:
10
Formal Charge:
0
Complexity:
134
Isotope Atom Count:
0
Defined Atom Stereocenter Count:
2
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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