2-Propen-1-ol

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

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

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

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.