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| CAS No.: | 105-30-6 |
|---|---|
| Name: | 2-METHYL-1-PENTANOL |
| Article Data: | 149 |
| Cas Database | |
| Molecular Structure: | |
|
|
|
| Formula: | C6H14O |
| Molecular Weight: | 102.177 |
| Synonyms: | 2-MPOH;2-Methyl-1-pentanol;2-Methylpentanol-1;NSC 6250; |
| EINECS: | 203-285-1 |
| Density: | 0.814 g/cm3 |
| Melting Point: | -48.42°C (estimate) |
| Boiling Point: | 151.599 °C at 760 mmHg |
| Flash Point: | 51.667 °C |
| Solubility: | 5.96g/L(25 oC) |
| Appearance: | clear colourless liquid |
| Hazard Symbols: |
 Xn
|
| Risk Codes: | 10-22 |
| Safety: | 24/25 |
| Transport Information: | UN 1987 3/PG 3 |
| PSA: | 20.23000 |
| LogP: | 1.41490 |
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Chemistry
IUPAC Name: 2-Methylpentan-1-ol
Synonyms of Amyl methyl alcohol (CAS NO.105-30-6): Amyl methyl alcohol ; 2-Methyl-n-amyl alcohol ; 2-Methyl-1-penmnol ; 2-Methyl-1-pentanol ; 2-Propylpropanol ; (±)-2-Methyl-pentan-1-ol ; 1-Pentanol, 2-methyl- ; 2-Methyl-1-pentano
Product Categories: Alcohols;C2 to C6;Oxygen Compounds
Molecular Structure: 
Molecular Formula: C6H14O
Molecular Weight: 102.17
CAS NO: 105-30-6
EINECS : 203-285-1
Mol File: 105-30-6.mol
H bond acceptors: 1
H bond donors: 1
Freely Rotating Bonds: 4
Polar Surface Area: 9.23 Å2
Index of Refraction: 1.413
Molar Refractivity: 31.33 cm3
Molar Volume: 125.4 cm3
Surface Tension: 26.6 dyne/cm
Density: 0.814 g/cm3
Flash Point: 50.6 °C
Enthalpy of Vaporization: 44.84 kJ/mol
Boiling Point: 148 °C at 760 mmHg
Vapour Pressure: 1.67 mmHg at 25°C
Appearance: Amyl methyl alcohol (CAS NO.105-30-6) is clear colourless liquid.
SMILES: OCC(C)CCC
InChI: InChI=1/C6H14O/c1-3-4-6(2)5-7/h6-7H,3-5H2,1-2H3
InChIKey: PFNHSEQQEPMLNI-UHFFFAOYAK
Std. InChI: InChI=1S/C6H14O/c1-3-4-6(2)5-7/h6-7H,3-5H2,1-2H3
Std. InChIKey: PFNHSEQQEPMLNI-UHFFFAOYSA-N
Toxicity Data With Reference
| Organism | Test Type | Route | Reported Dose (Normalized Dose) | Effect | Source |
|---|---|---|---|---|---|
| human | TCLo | inhalation | 50ppm (50ppm) | SENSE ORGANS AND SPECIAL SENSES: OTHER: EYE | Journal of Industrial Hygiene and Toxicology. Vol. 28, Pg. 262, 1946. |
| mouse | LD50 | oral | > 3200mg/kg (3200mg/kg) | Kodak Company Reports. Vol. 21MAY1971, | |
| rabbit | LD50 | skin | 3560uL/kg (3.56mL/kg) | AMA Archives of Industrial Hygiene and Occupational Medicine. Vol. 10, Pg. 61, 1954. | |
| rat | LC | inhalation | > 5000ppm/6H (5000ppm) | Kodak Company Reports. Vol. 21MAY1971, | |
| rat | LD50 | oral | 1410mg/kg (1410mg/kg) | AMA Archives of Industrial Hygiene and Occupational Medicine. Vol. 10, Pg. 61, 1954 |
Consensus Reports
Reported in EPA TSCA Inventory.
Safety Profile
Moderately toxic by ingestion and skin contact. A skin and severe eye irritant. Human systemic irritant by inhalation. A flammable liquid; can react with oxidizing materials. To fight fire, use CO2, dry chemical. When heated to decomposition it emits smoke and acrid fumes
Hazard Codes: 
Xn
Risk Statements: 10-22
R10: Amyl methyl alcohol (CAS NO.105-30-6) is flammable.
R22: Harmful if swallowed.
Safety Statements: 24/25
S24/25: Avoid contact with skin and eyes.
RIDADR: UN 1987 3/PG 3
WGK Germany: 3
RTECS: SA7175000
HazardClass: 3.2
PackingGroup: III
Analytical Methods
For occupational chemical analysis use NIOSH: Alcohols III, 1402.