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| CAS No.: | 24632-48-2 |
|---|---|
| Name: | 1-Piperazineaceticacid, 4-methyl-, 2-[(5-nitro-2-furanyl)methylene]hydrazide, hydrochloride (1:2) |
| Molecular Structure: | |
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|
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| Formula: | C12H17 N5 O4 . 2 Cl H |
| Molecular Weight: | 368.26 |
| Synonyms: | 1-Piperazineaceticacid, 4-methyl-, (5-nitrofurfurylidene)hydrazide, dihydrochloride (8CI);1-Piperazineacetic acid, 4-methyl-, [(5-nitro-2-furanyl)methylene]hydrazide,dihydrochloride (9CI); Nifurpipone dihydrochloride |
| Density: | 1.41g/cm3 |
| Boiling Point: | °Cat760mmHg |
| Flash Point: | °C |
| Safety: | Poison by intravenous and intraperitoneal routes. Moderately toxic by ingestion. When heated to decomposition it emits toxic fumes of NOx and HCl. |
| PSA: | 110.39000 |
| LogP: | 2.72860 |
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Chemistry
Empirical Formula of Nifurpipone dihydrochloride (CAS NO.24632-48-2): C12H19Cl2N5O4
Molecular Weight: 368.2164
Flash Point: 249.4 °C
Enthalpy of Vaporization: 76.93 kJ/mol
Boiling Point: 488.7 °C at 760 mmHg
Vapour Pressure: 6.13E-10 mmHg at 25 °C
Structure of Nifurpipone dihydrochloride (CAS NO.24632-48-2):
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IUPAC Name: 2-(4-Methylpiperazin-1-yl)-N-[(E)-(5-nitrofuran-2-yl)methylideneamino] acetamide dihydrochloride
Canonical SMILES: CN1CCN(CC1)CC(=O)NN=CC2=CC=C(O2)[N+](=O)[O-].Cl.Cl
Isomeric SMILES: CN1CCN(CC1)CC(=O)N/N=C/C2=CC=C(O2)[N+](=O)[O-].Cl.Cl
InChI: InChI=1S/C12H17N5O4.2ClH/c1-15-4-6-16(7-5-15)9-11(18)14-13-8-10-2-3-12(21-10)17(19)20;;/h2-3,8H,4-7,9H2,1H3,(H,14,18);2*1H/b13-8+;;
InChIKey: HBDZTPOTPYFNQV-LIYVDSPJSA-N
Toxicity Data With Reference
| 1. | orl-rat LD50:960 mg/kg | BCFAAI Bollettino Chimico Farmaceutico. 114 (1975),73. | ||
| 2. | orl-mus LD50:688 mg/kg | BCFAAI Bollettino Chimico Farmaceutico. 114 (1975),73. | ||
| 3. | ipr-mus LD50:252 mg/kg | BCFAAI Bollettino Chimico Farmaceutico. 114 (1975),73. | ||
| 4. | ivn-mus LD50:222 mg/kg | BCFAAI Bollettino Chimico Farmaceutico. 114 (1975),73. |
Safety Profile
Poison by intravenous and intraperitoneal routes. Moderately toxic by ingestion. When heated to decomposition Nifurpipone dihydrochloride (CAS NO.24632-48-2) emits toxic fumes of NOx and HCl.
Specification
Nifurpipone dihydrochloride , its cas register number is 24632-48-2. It also can be called 1-Piperazineacetic acid, 4-methyl-, (5-nitrofurfurylidene)hydrazide, dihydrochloride ; 4-Methyl-1-piperazineacetic acid (5-nitrofurfurylidene)hydrazide dihydrochloride ; and 1-Piperazineacetic acid, 4-methyl-, ((5-nitro-2-furanyl)methylene)hydrazine, dihydrochloride .