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| CAS No.: | 17471-82-8 |
|---|---|
| Name: | (1,4-benzodioxan-6-ylmethyl)guanidinium sulphate (2:1) |
| Molecular Structure: | |
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| Formula: | C10H13N3O2•½H2O4S |
| Molecular Weight: | 256.26 |
| Synonyms: | EINECS 241-487-1;Guabenxane;Guanidino-6-methyl-1,4-benzodioxane;Hemisulfate de guanidino methyl-6 benzodioxanne-1,4 [French];(1,4-Benzodioxan-6-ylmethyl)guanidinium sulphate (2:1);6-Guanidinomethyl 1,4-benzodioxane sulfate;GUANIDINE,(1,4-BENZODIOXAN-6-YLMETHYL)-,SULFATE (2:1);LM 433;1-(1,4-Benzodioxan-6-ylmethyl)guanidine sulfate (2:1);Guanidino methyl-6 benzodioxanne-1,4 [French]; |
| Density: | 1.4g/cm3 |
| Boiling Point: | 390.9°Cat760mmHg |
| Flash Point: | 190.2°C |
| Safety: | Poison by intravenous and intraperitoneal routes. Moderately toxic by ingestion. When heated to decomposition it emits toxic fumes of NOx and SOx. See also SULFATES. |
| PSA: | 243.70000 |
| LogP: | 3.69160 |
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Chemistry
IUPAC Name: [N'-(2,3-Dihydro-1,4-benzodioxin-7-ylmethyl)carbamimidoyl]azanium;hydrogen sulfate
Molecular Formula: C10H13N3O2•H2SO4
Molecular Weight: 256.26g/mol
EINECS: 241-487-1
Density: 1.4g/cm3
Melting Point: 205°C
Boiling Point: 390.9°C at 760mmHg
Flash Point: 190.2°C
Properties: crystals from H2O
Freely Rotating Bonds: 2
Polar Surface Area: 37.3 Å2
Index of Refraction: 1.639
Molar Refractivity: 53.19 cm3
Molar Volume: 147.8 cm3
Polarizability: 21.08 ×10-24 cm3
Surface Tension: 55.3 dyne/cm
Enthalpy of Vaporization: 64.04 kJ/mol
Vapour Pressure: 2.57E-06 mmHg at 25°C
The Cas Register Number of Guabenxane is 17471-82-8.The chemical synonyms of Guabenxane (CAS NO.17471-82-8) are Guabenxane ; Guanidino-6-methyl-1,4-benzodioxane ; LM 433 ; CID28562 ; Guanidino methyl-6 benzodioxanne-1,4
6-Guanidinomethyl 1,4-benzodioxane sulfate ; Guanidino methyl-6 benzodioxanne-1,4 ; LS-73242 ; (1,4-Benzodioxan-6-ylmethyl)guanidinium sulphate (2:1) .The molecular structure of Guabenxane (CAS NO.17471-82-8) is.png)
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Uses
Guabenxane (CAS NO.17471-82-8) is used as pharmaceutical.
Toxicity Data With Reference
| 1. | ipr-rat LD50:243 mg/kg | EJMCA5 European Journal of Medicinal Chemistry. Chimie Therapeutique. 12 (1977),241. | ||
| 2. | orl-mus LD50:535 mg/kg | EJMCA5 European Journal of Medicinal Chemistry. Chimie Therapeutique. 12 (1977),241. | ||
| 3. | ipr-mus LD50:179 mg/kg | EJMCA5 European Journal of Medicinal Chemistry. Chimie Therapeutique. 12 (1977),241. | ||
| 4. | ivn-mus LD50:46 mg/kg | EJMCA5 European Journal of Medicinal Chemistry. Chimie Therapeutique. 12 (1977),241. |
Safety Profile
Poison by intravenous and intraperitoneal routes. Moderately toxic by ingestion. When heated to decomposition it emits toxic fumes of NOx and SOx. See also SULFATES.