IUPAC Name: Pentan-3-ol
CAS: 584-02-1
EINECS: 209-526-7
Product Categories: Industrial/Fine chemicals
Following is the Molecular Structure of Isoamyl alcohol (584-02-1):
SMILES: OC(CC)CC
InChI: InChI=1/C5H12O/c1-3-5(6)4-2/h5-6H,3-4H2,1-2H3
InChIKey: AQIXEPGDORPWBJ-UHFFFAOYAU
Std.InChI: InChI=1S/C5H12O/c1-3-5(6)4-2/h5-6H,3-4H2,1-2H3
Std.InChIKey: AQIXEPGDORPWBJ-UHFFFAOYSA-N
Molecular Formula: C5H12O
Molecular Weight: 88.15
Melting Point: -75℃
Boiling Point: 115.3℃ at 760mmHg
Flash Point: 40.6℃
Molar Volume: 108.9cm3
Density: 0.809g/cm3
Molar Refractivity: 26.7cm3
Surface Tension: 25.6dyne/cm
Polarizability: 10.58 10-24cm3
Enthalpy of Vaporization: 41.22kJ/mol
Vapour Pressure: 9.66mmHg at 25℃
Index of Refraction: 1.405
Refractive Index: n20/D 1.410(lit.)
Water Solubility: 5.5g/100mL(30℃)
Used as a flotation agent,a solvent,and in organic synthesis.
rabbit | LD50 | skin | 2520uL/kg (2.52mL/kg) | AMA Archives of Industrial Hygiene and Occupational Medicine. Vol. 10, Pg. 61, 1954. | |
rat | LD50 | oral | 1870mg/kg (1870mg/kg) | AMA Archives of Industrial Hygiene and Occupational Medicine. Vol. 10, Pg. 61, 1954. | |
rat | LDLo | intraperitoneal | 1950mg/kg (1950mg/kg) | Journal of Industrial Hygiene and Toxicology. Vol. 27, Pg. 1, 1945. |
Reported in EPA TSCA Inventory.
Hazard Codes: Xn Harmful.
Risk Statements 10-20-37-66
R10: Flammable.
R20: Harmful by inhalation.
R37: Irritating to the respiratory system.
R66: Repeated exposure may cause skin dryness or cracking.
Safety Statements: 46
S46: If swallowed,seek medical advice immediately and show this container or label.
RIDADR: UN 1105 3/PG 3
WGK: Germany 1
RTECS: SA5075000
HazardClass: 3
PackingGroup: III
HS Code: 29051500
Moderately toxic by ingestion,skin contact,and intraperitoneal routes.A severe eye and mild skin irritant.
OSHA PEL: TWA 100 ppm; STEL 125 ppm.
ACGIH TLV: TWA 100 ppm; STEL 125 ppm.
DFG MAK: 100 ppm (360 mg/m3).
Isoamyl alcohol (584-02-1),which also can be called for (C2H5)2CHOH ; 1-Ethyl-1-propanol ; 3-Pentyl alcohol ; 3-Pentylalcohol ; Alcool3-pentylique ; Diethylcarbinol(3-pentanol) ; Pentan-3-ol ; Pentanol(non-specificname) . Isoamyl alcohol (584-02-1) is viscous, colorless liquid with a characteristic,slightly pungent and penetrating odor. It's soluble in water.This chemical is stable under normal temperatures and pressures.After decomposition, Isoamyl alcohol (584-02-1) turned into Carbon monoxide ,irritating and toxic fumes and gases, Carbon dioxide .Take care of this chemical is flammable.When heated to decomposition it emits acrid smoke and irritating fumes.
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