Please Wait
Applying Filters...
Menu
$ API Ref.Price (USD/KG) : 6Xls
2D Structure
Also known as: 14396-16-8, Piperazine 2-hydroxypropane-1,2,3-tricarboxylate, 2-hydroxypropane-1,2,3-tricarboxylic acid;piperazine, Piperazinecitrate, Oxyzin (syrup), Piperazine citrate (1:1)
Molecular Formula
C10H18N2O7
Molecular Weight
278.26  g/mol
InChI Key
SWDXALWLRYIJHK-UHFFFAOYSA-N

1 2D Structure

2D Structure

2 Identification
2.1 Computed Descriptors
2.1.1 IUPAC Name
2-hydroxypropane-1,2,3-tricarboxylic acid;piperazine
2.1.2 InChI
InChI=1S/C6H8O7.C4H10N2/c7-3(8)1-6(13,5(11)12)2-4(9)10;1-2-6-4-3-5-1/h13H,1-2H2,(H,7,8)(H,9,10)(H,11,12);5-6H,1-4H2
2.1.3 InChI Key
SWDXALWLRYIJHK-UHFFFAOYSA-N
2.1.4 Canonical SMILES
C1CNCCN1.C(C(=O)O)C(CC(=O)O)(C(=O)O)O
2.2 Synonyms
2.2.1 Depositor-Supplied Synonyms

1. 14396-16-8

2. Piperazine 2-hydroxypropane-1,2,3-tricarboxylate

3. 2-hydroxypropane-1,2,3-tricarboxylic Acid;piperazine

4. Piperazinecitrate

5. Oxyzin (syrup)

6. Piperazine Citrate (1:1)

7. Schembl125278

8. Dtxsid20921081

9. Amy40769

10. Nsc86779

11. Piperazine Compound With Citric Acid

12. Nsc203336

13. Akos015920444

14. Gs-3869

15. Nsc-203336

16. Piperazine,2,3-propanetricarboxylate (3:2)

17. E75921

18. A808202

19. 2-hydroxypropane-1,2,3-tricarboxylic Acid--piperazine (1/1)

20. Wln: T6m Dmtj & 3 & 622 & Qv1xqvq1vq & 2 & 621

21. 113484-97-2

2.3 Create Date
2005-03-26
3 Chemical and Physical Properties
Molecular Weight 278.26 g/mol
Molecular Formula C10H18N2O7
Hydrogen Bond Donor Count6
Hydrogen Bond Acceptor Count9
Rotatable Bond Count5
Exact Mass278.11140092 g/mol
Monoisotopic Mass278.11140092 g/mol
Topological Polar Surface Area156 Ų
Heavy Atom Count19
Formal Charge0
Complexity254
Isotope Atom Count0
Defined Atom Stereocenter Count0
Undefined Atom Stereocenter Count0
Defined Bond Stereocenter Count0
Undefined Bond Stereocenter Count0
Covalently Bonded Unit Count2