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Piperazine Citrate
CAS: 144-29-6 | C10H18N2O7
2D Structure
3D Structure
Loading 3D structure...
Basic Information
- CAS Registry Number
- 144-29-6
- Molecular Formula
- C10H18N2O7
- Molecular Mass
- 278.26 g/mol
Identifiers
CAS Registry Number
144-29-6
SMILES
C1CNCCN1.O=C(O)CC(O)(CC(=O)O)C(=O)O
InChI Key
SWDXALWLRYIJHK-UHFFFAOYSA-N
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
Names and Synonyms
- Piperazine Citrate Common Name
- Piperazine, 2-hydroxy-1,2,3-propanetricarboxylate (3:2) Synonym
- Piperazine, citrate (3:2) Synonym
- Piperazine citrate Synonym
- Antepar Synonym
- Anthecole Synonym
- Antoban Synonym
- Arpezine Synonym
- Ascarex Syrup Synonym
- Exelmin Synonym
- Helmezine Synonym
- Multifuge Citrate Synonym
- Oxucide Synonym
- Parazine Synonym
- Pin-Tega Synonym
- Piperazine Citrate Telra Synonym
- Pipizan Synonym
- Pipizan Citrate Syrup Synonym
- Rhomex Synonym
- Ta-Verm Synonym
- Vermago Synonym
- Piperasol Synonym
- Tripiperazine dicitrate Synonym
- Multifuge Synonym
- Nemadital Synonym
- Pinozan Synonym
- Exopin Synonym
- Bryrel Synonym
- Tasnon Synonym
- Vermizine (elixir) Synonym
- Coliurinal Synonym
- Pipizan citrate Synonym
- Worm Away Synonym
- Patazine Synonym
- Citraazine Synonym
All Properties
Comprehensive physical and chemical properties
| Property | Value | Source |
|---|---|---|
| Molecular Mass | 278.26 g/mol | CAS Common Chemistry |
| 278.26099999999997 g/mol | RDKit | |
| 278.261 g/mol | RDKit | |
| Canonical SMILES | O=C(O)CC(O)(C(=O)O)CC(=O)O.N1CCNCC1 | CAS Common Chemistry |
| 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 | CAS Common Chemistry |
| InChI Key | InChIKey=SWDXALWLRYIJHK-UHFFFAOYSA-N | CAS Common Chemistry |
| Melting Point | 182-187 °C (decomp) | CAS Common Chemistry |
| Name | Piperazine citrate | CAS Common Chemistry |
| Heavy Atom Count | 19 | RDKit |
| Hydrogen Bond Acceptors | 6 | RDKit |
| Hydrogen Bond Donors | 6 | RDKit |
| Rotatable Bonds | 5 | RDKit |
| Aromatic Ring Count | 0 | RDKit |
| Topological Polar Surface Area | 156.19 Ų | RDKit |
| LogP | -2.0692999999999975 | RDKit |
| -2.0693 | RDKit | |
| Molar Refractivity | 62.83060000000002 cm³/mol | RDKit |
| Ring Count | 1 | RDKit |
| Formal Charge | 0 | RDKit |
| Fraction Csp3 | 0.7 | RDKit |
| Exact Mass | 278.111400916 g/mol | RDKit |
Spectral Data
NMR, IR, and Mass spectral data
Predicting NMR spectra...
10 ppm
9
8
7
6
5
4
3
2
1
0 ppm
| Shift (ppm) | Multiplicity | Integration | Assignment |
|---|
200 ppm
180
160
140
120
100
80
60
40
20
0 ppm
| Shift (ppm) | DEPT | Assignment |
|---|
Note: These NMR spectra are predicted computationally and may differ from experimental data. Predictions are based on chemical environment analysis.
External Resources
Related
Related molecules
Other compounds with formula C10H18N2O7.
