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Substance Name: Allyl chloride
RN: 107-05-1
UNII: V2RFT0R50S
InChIKey: OSDWBNJEKMUWAV-UHFFFAOYSA-N

Note

  • Causes toxic polyneuropathy.

Molecular Formula

  • C3-H5-Cl

Molecular Weight

  • 76.5255
 

Classification Codes

Classification Codes

  • Human Data
  • Mutation Data
  • Reproductive Effect
  • Skin / Eye Irritant
  • Tumor Data

Superlist Classification Codes

  • Overall Carcinogenic Evaluation: Group 3
  • Reportable Quantity (RQ) = 1000 lb
  • TWA (1 ppm); STEL (2 ppm); Confirmed animal carcinogen with unknown relevance to humans
  • TWA 1 ppm (3 mg/m3)

Names and Synonyms

Name of Substance

  • Allyl chloride

Synonyms

  • 1-Chloro-2-propene
  • 1-Propene, 3-chloro-
  • 2-Propenyl chloride
  • 3-Chloro-1-propylene
  • 3-Chloropropene
  • 3-Chloropropene-1
  • 3-Chloropropylene
  • 3-Chlorpropen
  • 3-Chlorpropen [German]
  • 4-01-00-00738 (Beilstein Handbook Reference)
  • Allile (cloruro di)
  • Allile (cloruro di) [Italian]
  • Allyl chloride
  • Allylchlorid
  • Allylchlorid [German]
  • Allyle (chlorure d')
  • Allyle (chlorure d') [French]
  • alpha-Chloropropylene
  • BRN 0635704
  • CCRIS 19
  • Chlorallylene
  • Chloro-2-propene
  • Chloroallylene
  • EC 203-457-6
  • EINECS 203-457-6
  • HSDB 178
  • NCI-C04615
  • NSC 20939
  • p-Aminopropiofenon
  • p-Aminopropiofenon [Czech]
  • Propene, 3-chloro-
  • UNII-V2RFT0R50S

Systematic Names

  • 1-Propene, 3-chloro-
  • 3-Chloro-1-propene
  • 3-Chloropropene
  • Allyl chloride
  • Propene, 3-chloro-

Superlist Names

  • 1-Chloropropylene
  • 3-Chloropropene
  • Allyl chloride
  • Allyl chloride [UN1100] [Flammable liquid]
  • alpha-Chloropropylene
  • Propene, 3-chloro-
  • UN1100

Registry Numbers

CAS Registry Number

  • 107-05-1

FDA UNII

  • V2RFT0R50S

System Generated Number

  • 0000107051

Structure Descriptors

InChI

1S/C3H5Cl/c1-2-3-4/h2H,1,3H2

InChIKey

OSDWBNJEKMUWAV-UHFFFAOYSA-N

Smiles

C(CCl)=C

Toxicity

Organism Test Type Route Reported Dose (Normalized Dose) Effect Source
cat LCLo inhalation 10500mg/m3/2H (10500mg/m3) LUNGS, THORAX, OR RESPIRATION: RESPIRATORY DEPRESSION

BEHAVIORAL: ATAXIA

BEHAVIORAL: SOMNOLENCE (GENERAL DEPRESSED ACTIVITY)
Ecotoxicology and Environmental Safety. Vol. 6, Pg. 19, 1982.
guinea pig LC50 inhalation 5800mg/m3/2H (5800mg/m3) BEHAVIORAL: SOMNOLENCE (GENERAL DEPRESSED ACTIVITY)

LUNGS, THORAX, OR RESPIRATION: RESPIRATORY DEPRESSION

SENSE ORGANS AND SPECIAL SENSES: LACRIMATION: EYE
Ecotoxicology and Environmental Safety. Vol. 6, Pg. 19, 1982.
human LCLo inhalation 3000ppm (3000ppm)   "Toxicology of Drugs and Chemicals," Deichmann, W.B., New York, Academic Press, Inc., 1969Vol. -, Pg. 86, 1969.
mouse LC50 inhalation 11500mg/m3/2H (11500mg/m3) SENSE ORGANS AND SPECIAL SENSES: LACRIMATION: EYE

BEHAVIORAL: SOMNOLENCE (GENERAL DEPRESSED ACTIVITY)

LUNGS, THORAX, OR RESPIRATION: RESPIRATORY DEPRESSION
Ecotoxicology and Environmental Safety. Vol. 6, Pg. 19, 1982.
mouse LD50 intraperitoneal 155mg/kg (155mg/kg)   Shell Chemical Company. Unpublished Report. Vol. -, Pg. 1, 1961.
mouse LD50 oral 425mg/kg (425mg/kg) LUNGS, THORAX, OR RESPIRATION: DYSPNEA

BEHAVIORAL: SOMNOLENCE (GENERAL DEPRESSED ACTIVITY)

BEHAVIORAL: TREMOR
Ecotoxicology and Environmental Safety. Vol. 6, Pg. 19, 1982.
rabbit LCLo inhalation 22500mg/m3/2H (22500mg/m3) LUNGS, THORAX, OR RESPIRATION: RESPIRATORY DEPRESSION

SENSE ORGANS AND SPECIAL SENSES: LACRIMATION: EYE

BEHAVIORAL: SOMNOLENCE (GENERAL DEPRESSED ACTIVITY)
Ecotoxicology and Environmental Safety. Vol. 6, Pg. 19, 1982.
rabbit LD50 skin 2066mg/kg (2066mg/kg)   Journal of Industrial Hygiene and Toxicology. Vol. 30, Pg. 63, 1948.
rat LC50 inhalation 11gm/m3/2H (11000mg/m3) GASTROINTESTINAL: ULCERATION OR BLEEDING FROM DUODENUM

LUNGS, THORAX, OR RESPIRATION: RESPIRATORY DEPRESSION

SENSE ORGANS AND SPECIAL SENSES: LACRIMATION: EYE
Ecotoxicology and Environmental Safety. Vol. 6, Pg. 19, 1982.
rat LD50 oral 460mg/kg (460mg/kg) LUNGS, THORAX, OR RESPIRATION: DYSPNEA

BEHAVIORAL: CONVULSIONS OR EFFECT ON SEIZURE THRESHOLD

BEHAVIORAL: TREMOR
Ecotoxicology and Environmental Safety. Vol. 6, Pg. 19, 1982.

Physical Properties

Physical Property Value Units Temp (deg C) Source
Melting Point -1.35E+02 deg C   EXP
Boiling Point 45.1 deg C   EXP
log P (octanol-water) 1.930 (none)   EST
Water Solubility 3370 mg/L 25 EXP
Vapor Pressure 368 mm Hg 25 EXP
Henry's Law Constant 0.011 atm-m3/mole 25 EST
Atmospheric OH Rate Constant 1.70E-11 cm3/molecule-sec 25 EXP

Physical property data is provided to ChemIDplus by SRC, Inc.