Allyl-alcohol: 0 Products found
Name
Allyl-alcohol
EINECS
203-470-7
CAS No.
107-18-6
Density
0.822 g/cm3
Solubility
Miscible with water
Melting Point
-129 °C
Formula
C3H6O
Boiling Point
99 °C at 760 mmHg
Molecular Weight
58.09
Flash Point
22.222 °C
Transport Information
UN 1098 6.1/PG 1
Appearance
colourless liquid with a mustard-like odour
Safety
36/37/39-38-45-61
Risk Codes
10-23/24/25-36/37/38-50
Molecular Structure
Hazard Symbols
Synonyms
Allylalcohol (8CI);1-Hydroxy-2-propene;1-Propen-3-ol;2-Propenol;2-Propenylalcohol;3-Hydroxy-1-propene;3-Hydroxypropene;NSC 6526;Shell unkrauttod A;Vinylcarbinol;

History

Formaldehyde was first reported by the Russian chemist Aleksandr Butlerov (1828-1886), but it was conclusively identified by August Wilhelm von Hofmann.

Consensus

EPA Extremely Hazardous Substances List. Reported in EPA TSCA Inventory.

Standards

OSHA PEL: TWA 2 ppm; STEL 4 ppm (skin)
ACGIH TLV: 0.5 ppm (skin); Not Classifiable as a Human Carcinogen
DFG MAK: Confirmed Animal Carcinogen with Unknown Relevance to Humans
DOT Classification:  6.1; Label: Poison, Flammable Liquid

AnalyticalMethods

For occupational chemical analysis use NIOSH: Alcohols III, 1402.

Others

The Allyl alcohol, also known as 3-Hydroxypropene, is an organic compound with the formula C3H6O. It belongs to the product category of Pharmaceutical Intermediates. Its EINECS registry number is 203-470-7. With the CAS registry number 107-18-6, its IUPAC name is prop-2-en-1-ol.

Physical properties of Allyl alcohol: (1)ACD/LogP: 0.13; (2)ACD/LogD (pH 5.5): 0.128; (3)ACD/LogD (pH 7.4): 0.128; (4)ACD/BCF (pH 5.5): 1; (5)ACD/BCF (pH 7.4): 1; (6)ACD/KOC (pH 5.5): 27.958; (7)ACD/KOC (pH 7.4): 27.958; (8)#H bond acceptors: 1; (9)#H bond donors: 1; (10)#Freely Rotating Bonds: 2; (11)Index of Refraction: 1.402; (12)Molar Refractivity: 17.208 cm3; (13)Molar Volume: 70.655 cm3; (14)Surface Tension: 24.53 dyne/cm; (15)Density: 0.822 g/cm3; (16)Flash Point: 22.222 °C; (17)Enthalpy of Vaporization: 39.45 kJ/mol; (18)Boiling Point: 99.025 °C at 760 mmHg; (19)Vapour Pressure: 22.334 mmHg at 25°C.

Preparation: Allyl alcohol can be obtained by many methods. The hydrolysis of allyl chloride is the traditional route:

CH2CHCH2Cl + NaOH → CH2CHCH2OH + NaCl

Uses: Allyl alcohol is mainly converted to glycidol, which is a chemical intermediate in the synthesis of glycerol, glycidyl ethers, esters and amines. Also, a variety of polymerizable esters are prepared from allyl alcohol, e.g. diallyl phthalate.

When you are using this chemical, please be cautious about it as the following:
This chemical that at low levels can cause damage to health. It may present an immediate or delayed danger to one or more components of the environment. It is irritating to eyes, respiratory system and skin. In case of contact with eyes, you should rinse immediately with plenty of water and seek medical advice. Whenever you will contact it, please wear suitable protective clothing, gloves and eye/face protection.

You can still convert the following datas into molecular structure:
(1)Canonical SMILES: C=CCO
(2)InChI: InChI=1S/C3H6O/c1-2-3-4/h2,4H,1,3H2
(3)InChIKey: XXROGKLTLUQVRX-UHFFFAOYSA-N

The toxicity data is as follows:

Organism Test Type Route Reported Dose (Normalized Dose) Effect Source
dog LDLo unreported 4270ug/kg (4.27mg/kg) BEHAVIORAL: COMA

GASTROINTESTINAL: NAUSEA OR VOMITING

BLOOD: OTHER CHANGES
Journal of Pharmacology and Experimental Therapeutics. Vol. 25, Pg. 144, 1925.
frog LDLo parenteral 51mg/kg (51mg/kg) BEHAVIORAL: EXCITEMENT

GASTROINTESTINAL: NAUSEA OR VOMITING
Archives Internationales de Pharmacodynamie et de Therapie. Vol. 50, Pg. 296, 1935.
mammal (species unspecified) LC50 inhalation 1gm/m3 (1000mg/m3)   Gigiena Truda i Professional'nye Zabolevaniya. Labor Hygiene and Occupational Diseases. Vol. 32(10), Pg. 25, 1988.
mammal (species unspecified) LD50 oral 70mg/kg (70mg/kg)   Gigiena Truda i Professional'nye Zabolevaniya. Labor Hygiene and Occupational Diseases. Vol. 32(10), Pg. 25, 1988.
mammal (species unspecified) LD50 unreported 66mg/kg (66mg/kg)   Gigiena i Sanitariya. For English translation, see HYSAAV. Vol. 51(5), Pg. 61, 1986.
monkey LCLo inhalation 1000ppm/4H (1000ppm) GASTROINTESTINAL: "HYPERMOTILITY, DIARRHEA"

BLOOD: HEMORRHAGE
JAMA, Journal of the American Medical Association. Vol. 98, Pg. 2269, 1932.
mouse LC50 inhalation 500mg/m3/2H (500mg/m3)   "Toxicometric Parameters of Industrial Toxic Chemicals Under Single Exposure," Izmerov, N.F., et al., Moscow, Centre of International Projects, GKNT, 1982Vol. -, Pg. 17, 1982.
mouse LD50 intraperitoneal 60mg/kg (60mg/kg) BEHAVIORAL: SOMNOLENCE (GENERAL DEPRESSED ACTIVITY)

BEHAVIORAL: EXCITEMENT

BEHAVIORAL: ATAXIA
AMA Archives of Industrial Health. Vol. 18, Pg. 303, 1958.
mouse LD50 intravenous 78mg/kg (78mg/kg)   Archives Internationales de Pharmacodynamie et de Therapie. Vol. 135, Pg. 330, 1962.
mouse LD50 oral 96mg/kg (96mg/kg) LUNGS, THORAX, OR RESPIRATION: ACUTE PULMONARY EDEMA

BEHAVIORAL: ATAXIA
AMA Archives of Industrial Health. Vol. 18, Pg. 303, 1958.
rabbit LCLo inhalation 1000ppm/3.5H (1000ppm) SENSE ORGANS AND SPECIAL SENSES: IRITIS: EYE

BLOOD: HEMORRHAGE

LUNGS, THORAX, OR RESPIRATION: DYSPNEA
JAMA, Journal of the American Medical Association. Vol. 98, Pg. 2269, 1932.
rabbit LD50 oral 52mg/kg (52mg/kg)   National Technical Information Service. Vol. OTS0571508,
rabbit LD50 skin 45mg/kg (45mg/kg)   Journal of Industrial Hygiene and Toxicology. Vol. 30, Pg. 63, 1948.
rabbit LDLo subcutaneous 100mg/kg (100mg/kg)   "Zur Pharmakologie Ungesattigter Alkohole, Dissertation," Bock, H., Pharmakologischen Institu der Universitat Breslau, Poland, 1930Vol. -, Pg. -, 1930.
rat LC50 inhalation 76ppm/8H (76ppm) LUNGS, THORAX, OR RESPIRATION: ACUTE PULMONARY EDEMA AMA Archives of Industrial Health. Vol. 18, Pg. 303, 1958.
rat LD50 intraperitoneal 37mg/kg (37mg/kg)   Toxicology and Applied Pharmacology. Vol. 83, Pg. 108, 1986.
rat LD50 oral 64mg/kg (64mg/kg)   Journal of Industrial Hygiene and Toxicology. Vol. 30, Pg. 63, 1948.