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102-36-3

102-36-3 structural image
Product Name: Isocyanic acid 3,4-dichlorophenyl ester
Formula: C7H3Cl2NO
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CHEMICAL AND PHYSICAL PROPERTIES

Physical Description Isocyanic acid, 3,4-dichlorophenyl ester is a white to yellow solid. Used as a chemical intermediate and in organic synthesis. (EPA, 1998)
Color/Form White to yellow crystals
Boiling Point 244 °F at 18 mmHg (EPA, 1998)
Melting Point 113 °F (EPA, 1998)
Vapor Pressure VP: 5.6X10-1 mm Hg at 43 °C
Decomposition When heated to decomposition it emits toxic fumes of /hydrogen cyanide and nitrogen oxides/.
Viscosity 2X10-3 Pa.s at melting point
Other Experimental Properties Liquid Molar Volume = 0.1339 cu m/kmol
Chemical Classes Toxic Gases & Vapors -> Monoisocyanates

SAFETY INFORMATION

Signal word Danger
Pictogram(s)

Skull and Crossbones
Acute Toxicity
GHS06

Health Hazard
GHS08
GHS Hazard Statements H301:Acute toxicity,oral
H315:Skin corrosion/irritation
H317:Sensitisation, Skin
H319:Serious eye damage/eye irritation
H332:Acute toxicity,inhalation
H334:Sensitisation, respiratory
H335:Specific target organ toxicity, single exposure;Respiratory tract irritation
Precautionary Statement Codes P280:Wear protective gloves/protective clothing/eye protection/face protection.
P302+P352:IF ON SKIN: wash with plenty of soap and water.
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 188.01 g/mol
XLogP3 4.2
Hydrogen Bond Donor Count 0
Hydrogen Bond Acceptor Count 2
Rotatable Bond Count 1
Exact Mass 186.9591691 g/mol
Monoisotopic Mass 186.9591691 g/mol
Topological Polar Surface Area 29.4 Ų
Heavy Atom Count 11
Formal Charge 0
Complexity 179
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

Isocyanic acid, 3,4-dichlorophenyl ester is a white to yellow solid. Used as a chemical intermediate and in organic synthesis. (EPA, 1998)

RELATED SUPPLIERS

LANXESS India Pvt. Ltd.

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