Basic information
- Name:
Mannitol
- CAS No.:
87-78-5
- Molecular Structure:
- Formula:
- C6H14O6
- Molecular Weight:
- 182.20
- Deleted CAS:
- 133-43-7|5149-40-6|36413-61-3
- Synonyms:
- Mannidex 16700;Hexahydroxyhexane;hexane-1,2,3,4,5,6-hexol;
- EINECS:
- 201-770-2
- Density:
- 1.596 g/cm3
- Boiling Point:
- 494.9 °C at 760 mmHg
- Flash Point:
- 292.5 °C
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Chemistry
Molecular Structure of Mannitol (CAS NO.87-78-5):
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IUPAC Name: hexane-1,2,3,4,5,6-hexol
Empirical Formula: C6H14O6
Molecular Weight: 182.1718
H bond acceptors: 6
H bond donors: 6
Freely Rotating Bonds: 11
Polar Surface Area: 55.38 Å2
Index of Refraction: 1.597
Molar Refractivity: 38.89 cm3
Molar Volume: 114.1 cm3
Surface Tension: 99.8 dyne/cm
Density: 1.596 g/cm3
Flash Point: 292.5 °C
Enthalpy of Vaporization: 87.81 kJ/mol
Boiling Point: 494.9 °C at 760 mmHg
Vapour Pressure: 7.22E-12 mmHg at 25°C
InChI
InChI=1/C6H14O6/c7-1-3(9)5(11)6(12)4(10)2-8/h3-12H,1-2H2/t3-,4-,5-,6-/m1/s1
Smiles
OC[C@H]([C@H]([C@@H]([C@@H](CO)O)O)O)O
Uses
Mannitol (CAS NO.87-78-5) is used for dehydrant and diuretics. It is used as the analytical reagent, and it is also used in the resin and the drugs synthesis.
Toxicity Data With Reference
| Organism | Test Type | Route | Reported Dose (Normalized Dose) | Effect | Source |
|---|---|---|---|---|---|
| man | TDLo | intravenous | 5714mg/kg (5714mg/kg) | BEHAVIORAL: SOMNOLENCE (GENERAL DEPRESSED ACTIVITY) GASTROINTESTINAL: NAUSEA OR VOMITING KIDNEY, URETER, AND BLADDER: "CHANGES IN TUBULES (INCLUDING ACUTE RENAL FAILURE, ACUTE TUBULAR NECROSIS)" | Nephron. Vol. 45, Pg. 233, 1987. |
| rat | LD50 | intravenous | 25800uL/kg (25.8mL/kg) | Gekkan Yakuji. Pharmaceuticals Monthly. Vol. 9, Pg. 759, 1967. |
Safety Profile
A poison by intravenous route. Human systemic effects. When heated to decomposition it emits acrid smoke and irritating vapors.
Specification
Mannitol , with CAS number of 87-78-5, can be called Hexahydroxyhexane ; DL-Mannitol ; (2R,3R,4R,5R)-hexane-1,2,3,4,5,6-hexol ; hexane-1,2,3,4,5,6-hexol . Mannitol (CAS NO.87-78-5) is analytics reagents, also used for resin and drug synthesis.