-
Name
1,6-Dideoxy-1,6-Diiodo-D-Mannitol
- EINECS
- CAS No. 15430-91-8
- Density 2.0673 (estimate)
- Solubility
- Melting Point
- Formula C6H12 I2 O4
- Boiling Point 90.91°C (rough estimate)
- Molecular Weight 401.968
- Flash Point
- Transport Information
- Appearance
- Safety Moderately toxic by intraperitoneal route. When heated to decomposition it emits toxic vapors of I−.
- Risk Codes
-
Molecular Structure
- Hazard Symbols
- Synonyms Mannitol,1,6-dideoxy-1,6-diiodo-, D- (8CI); 1,6-Diiodo-1,6-dideoxy-D-mannitol;1,6-Diiodo-D-mannitol; NSC 114017
- PSA 80.92000
- LogP -0.70000
1,6-Dideoxy-1,6-Diiodo-D-Mannitol Chemical Properties
Chemistry informtion about 1,6-Dideoxy-1,6-Diiodo-D-Mannitol(CAS NO.15430-91-8) is:
IUPAC Name: 1,6-diiodohexane-2,3,4,5-tetrol
Synonyms: 1,6-Dideoxy-1,6-diiodo-D-mannitol ; 1,6-Diiodo-1,6-dideoxy-D-mannitol ; DJM
Molecular Weight: 401.96602 [g/mol]
Molecular Formula: C6H12I2O4
XLogP3-AA: 0
H-Bond Donor: 4
H-Bond Acceptor: 4
Density: 2.564 g/cm3
Flash Point: 236.7 °C
Enthalpy of Vaporization: 84.14 kJ/mol
Boiling Point: 467.7 °C at 760 mmHg
Vapour Pressure: 1.03E-10 mmHg at 25°C
Surface Tension: 84.5 dyne/cm
Following is the molecular structure of 1,6-Dideoxy-1,6-Diiodo-D-Mannitol(CAS NO.15430-91-8) is:
1,6-Dideoxy-1,6-Diiodo-D-Mannitol Toxicity Data With Reference
| Organism | Test Type | Route | Reported Dose (Normalized Dose) | Effect | Source |
|---|---|---|---|---|---|
| mouse | LD50 | intraperitoneal | 1500mg/kg (1500mg/kg) | Arzneimittel-Forschung. Drug Research. Vol. 17, Pg. 145, 1967. |
1,6-Dideoxy-1,6-Diiodo-D-Mannitol Safety Profile
Moderately toxic by intraperitoneal route. When heated to decomposition it emits toxic vapors of I−.
1,6-Dideoxy-1,6-Diiodo-D-Mannitol Specification
Descriptors Computed from Structure about 1,6-Dideoxy-1,6-Diiodo-D-Mannitol(CAS NO.15430-91-8) is:
Canonical SMILES: C(C(C(C(C(CI)O)O)O)O)I
InChI: InChI=1S/C6H12I2O4/c7-1-3(9)5(11)6(12)4(10)2-8/h3-6,9-12H,1-2H2
InChIKey: VSJYBSKARROHOH-UHFFFAOYSA-N
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