2,3-dimethyl piperazine-2,3-dicarboxylate - CAS 98493-22-2
Catalog: |
BB042172 |
Product Name: |
2,3-dimethyl piperazine-2,3-dicarboxylate |
CAS: |
98493-22-2 |
Synonyms: |
piperazine-2,3-dicarboxylic acid dimethyl ester; dimethyl piperazine-2,3-dicarboxylate |
IUPAC Name: | dimethyl piperazine-2,3-dicarboxylate |
Description: | 2,3-dimethyl piperazine-2,3-dicarboxylate (CAS# 98493-22-2 ) is a useful research chemical. |
Molecular Weight: | 202.21 |
Molecular Formula: | C8H14N2O4 |
Canonical SMILES: | COC(=O)C1C(NCCN1)C(=O)OC |
InChI: | InChI=1S/C8H14N2O4/c1-13-7(11)5-6(8(12)14-2)10-4-3-9-5/h5-6,9-10H,3-4H2,1-2H3 |
InChI Key: | POMPAIRUFJZDOQ-UHFFFAOYSA-N |
LogP: | -1.08000 |
Publication Number | Title | Priority Date |
US-3028388-A | Derivatives of piperazine | 19600127 |
Complexity: | 207 |
Compound Is Canonicalized: | Yes |
Covalently-Bonded Unit Count: | 1 |
Defined Atom Stereocenter Count: | 0 |
Defined Bond Stereocenter Count: | 0 |
Exact Mass: | 202.09535693 |
Formal Charge: | 0 |
Heavy Atom Count: | 14 |
Hydrogen Bond Acceptor Count: | 6 |
Hydrogen Bond Donor Count: | 2 |
Isotope Atom Count: | 0 |
Monoisotopic Mass: | 202.09535693 |
Rotatable Bond Count: | 4 |
Topological Polar Surface Area: | 76.7 |
Undefined Atom Stereocenter Count: | 2 |
Undefined Bond Stereocenter Count: | 0 |
XLogP3: | -0.9 |
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