2,5-Piperazinedione, 3,6-bis(hydroxymethyl)-, (3S,6S)-


Chemical Name: 2,5-Piperazinedione, 3,6-bis(hydroxymethyl)-, (3S,6S)-
CAS Number: 23409-30-5
Product Number: AG002N4K(AGN-PC-0O83KY)
Synonyms:
MDL No:
Molecular Formula: C6H10N2O4
Molecular Weight: 174.1546

Identification/Properties


Computed Properties
Molecular Weight:
174.156g/mol
XLogP3:
-1.5
Hydrogen Bond Donor Count:
4
Hydrogen Bond Acceptor Count:
4
Rotatable Bond Count:
2
Exact Mass:
174.064g/mol
Monoisotopic Mass:
174.064g/mol
Topological Polar Surface Area:
98.7A^2
Heavy Atom Count:
12
Formal Charge:
0
Complexity:
184
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

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Chemical Structure



cis-3,6-Bis(hydroxymethyl)piperazine-2,5-dione is a specialized compound used in chemical synthesis for its unique properties. With a molecular structure containing two hydroxymethyl groups and a piperazine-2,5-dione backbone, this compound plays a crucial role in various synthetic reactions. Its presence in a reaction mixture can lead to the formation of complex molecules with specific stereochemical configurations due to the cis double bond arrangement. In the field of organic chemistry, cis-3,6-Bis(hydroxymethyl)piperazine-2,5-dione is valued for its ability to act as a chelating agent, coordinating with metal ions and facilitating selective catalytic processes. Additionally, its hydroxymethyl groups are reactive sites for further functionalization, allowing chemists to introduce additional groups or modify its structure to tailor its properties for a desired application. Overall, this compound serves as a versatile building block in chemical synthesis, enabling the creation of structurally diverse molecules with controlled reactivity.