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2937-50-0

2937-50-0 structural image
Product Name: Allyl chloroformate
Formula: C4H5ClO2
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CHEMICAL AND PHYSICAL PROPERTIES

Physical Description Allyl chlorocarbonate appears as a colorless liquid with a pungent odor. Flash point 88 °F. Corrosive to metals and tissue. Very toxic by inhalation, ingestion and/or skin contact. Vapors are heavier than air.
Color/Form Hygroscopic liquid
Odor Pungent odor
Boiling Point 235 °F at 760 mmHg (USCG, 1999)
Melting Point -112 °F (USCG, 1999)
Flash Point 88 °F (USCG, 1999)
Solubility Insoluble in water
Density 1.139 at 68 °F (USCG, 1999) - Denser than water; will sink
Vapor Density 4.2 (Air = 1)
Vapor Pressure 20.0 [mmHg]
Decomposition When heated to decomposition it emits toxic fumes of /chlorine/.
Viscosity 0.71 mPa-s (cP) at 20 °C
Polymerization Polymerization may be caused by elevated temperature, oxidizers, peroxides.
Odor Threshold 1.4 PPM.
Refractive Index Index of Refraction = 1.4220 at 20 °C
Kovats Retention Index 730
Other Experimental Properties Ratio of specific heats of vapor (gas) 1.0804
Chemical Classes Toxic Gases & Vapors -> Acid Halides

SAFETY INFORMATION

Signal word Danger
Pictogram(s)

Flame
Flammables
GHS02

Corrosion
Corrosives
GHS05

Skull and Crossbones
Acute Toxicity
GHS06
GHS Hazard Statements H226:Flammable liquids
H301:Acute toxicity,oral
H314:Skin corrosion/irritation
H330:Acute toxicity,inhalation
Precautionary Statement Codes P210:Keep away from heat/sparks/open flames/hot surfaces. — No smoking.
P233:Keep container tightly closed.
P280:Wear protective gloves/protective clothing/eye protection/face protection.
P303+P361+P353:IF ON SKIN (or hair): Remove/Take off Immediately all contaminated clothing. Rinse SKIN with water/shower.
P305+P351+P338:IF IN EYES: Rinse cautiously with water for several minutes. Remove contact lenses, if present and easy to do. Continuerinsing.

COMPUTED DESCRIPTORS

Molecular Weight 120.53 g/mol
XLogP3 2
Hydrogen Bond Donor Count 0
Hydrogen Bond Acceptor Count 2
Rotatable Bond Count 3
Exact Mass 119.9978071 g/mol
Monoisotopic Mass 119.9978071 g/mol
Topological Polar Surface Area 26.3 Ų
Heavy Atom Count 7
Formal Charge 0
Complexity 79.8
Isotope Atom Count 0
Defined Atom Stereocenter Count 0
Undefined Atom Stereocenter Count 0
Defined Bond Stereocenter Count 0
Undefined Bond Stereocenter Count 0
Covalently-Bonded Unit Count 1
Compound Is Canonicalized Yes

PRODUCT INTRODUCTION

description

Allyl chlorocarbonate appears as a colorless liquid with a pungent odor. Flash point 88 °F. Corrosive to metals and tissue. Very toxic by inhalation, ingestion and/or skin contact. Vapors are heavier than air.

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