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| CAS No.: | 544-13-8 |
|---|---|
| Name: | Glutaronitrile |
| Molecular Structure: | |
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|
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| Formula: | C5H6 N2 |
| Molecular Weight: | 94.116 |
| Synonyms: | Glutaronitrile(6CI,7CI,8CI); 1,3-Dicyanopropane; 1,5-Pentanedinitrile; Glutaric aciddinitrile; Glutaric dinitrile; Glutarodinitrile; NSC 3807 |
| EINECS: | 208-861-6 |
| Density: | 0.995 |
| Melting Point: | -29 ºC |
| Boiling Point: | 285-287 ºC |
| Flash Point: | >230 °F |
| Solubility: | soluble |
| Appearance: | clear colorless to pale yellow liquid. |
| Hazard Symbols: |
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| Risk Codes: | R20/21/22;R36/38 |
| Safety: | Poison by subcutaneous route. Moderately toxic by ingestion. When heated to decomposition it emits very toxic fumes of NOx and CN−. See also NITRILES. |
| Transport Information: | UN 2810 |
| PSA: | 47.58000 |
| LogP: | 1.20386 |
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Chemistry
Chemical Name: Glutaronitrile
IUPAC NAME: Pentanedinitrile
CAS No.: 544-13-8
EINECS: 208-861-6
RTECS: YI3500000
Molecular Formula: C5H6N2
Molecular Weight: 94.11 g/mol
Melting Point: -29 °C(lit.)
Density: 0.961 g/cm3
Flash Point: 148.4 °C
Boiling Point: 287.3 °C at 760 mmHg
Following is the structure of 1,3-Trimethylenedinitrile (544-13-8):
Product Categories about 1,3-Trimethylenedinitrile (544-13-8) are Pharmaceutical Intermediates ; Dinitriles ; Dinitriles & Trinitriles
The chemical synonymous of 1,3-Trimethylenedinitrile (544-13-8) are 1,3-Dicyanopopane. ; Glutaric acid dinitrile ; Glutaric dinitrile ; glutaricaciddinitrile ; Glutarodinitrile ; Pentanedinitrlie ; Pyrotartaricacidnitrile ; Trimethylenedicyamide
Uses
1,3-Trimethylenedinitrile (544-13-8) is mainly used in organic synthesis.
Toxicity Data With Reference
| Organism | Test Type | Route | Reported Dose (Normalized Dose) | Effect | Source |
|---|---|---|---|---|---|
| dog | LDLo | subcutaneous | 50mg/kg (50mg/kg) | GASTROINTESTINAL: NAUSEA OR VOMITING | Archives Internationales de Pharmacodynamie et de Therapie. Vol. 3, Pg. 77, 1897. |
| frog | LDLo | subcutaneous | 3gm/kg (3000mg/kg) | Archives Internationales de Pharmacodynamie et de Therapie. Vol. 3, Pg. 77, 1897. | |
| mouse | LD50 | oral | 266mg/kg (266mg/kg) | Pharmacochemistry Library. Vol. 8, Pg. 73, 1985. | |
| pigeon | LDLo | subcutaneous | 1200mg/kg (1200mg/kg) | GASTROINTESTINAL: NAUSEA OR VOMITING | Archives Internationales de Pharmacodynamie et de Therapie. Vol. 3, Pg. 77, 1897. |
| rabbit | LDLo | subcutaneous | 18mg/kg (18mg/kg) | PERIPHERAL NERVE AND SENSATION: SPASTIC PARALYSIS WITH OR WITHOUT SENSORY CHANGE BEHAVIORAL: CONVULSIONS OR EFFECT ON SEIZURE THRESHOLD | Archives Internationales de Pharmacodynamie et de Therapie. Vol. 3, Pg. 77, 1897. |
Consensus Reports
Cyanide and its compounds are on the Community Right-To-Know List. Reported in EPA TSCA Inventory.
Safety Profile
Poison by subcutaneous route. Moderately toxic by ingestion. When heated to decomposition it emits very toxic fumes of NOx and CN−. See also NITRILES.
Hazard Codes:
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Risk Statements about 1,3-Trimethylenedinitrile (544-13-8):
R20/21/22 Harmful by inhalation, in contact with skin and if swallowed.
R36/38 Irritating to eyes and skin.
Safety Statements about 1,3-Trimethylenedinitrile (544-13-8):
S22 Do not breathe dust.
S26 In case of contact with eyes, rinse immediately with plenty of water and seek medical advice.
S36/37/39 Wear suitable protective clothing, gloves and eye/face protection.
Attentions:
1. Storage: Store in a cool, dry place. Store in a tightly closed container.
2. Handling: Avoid breathing dust, vapor, mist, or gas. Avoid contact with skin and eyes. Avoid ingestion and inhalation.