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1746-01-6

1746-01-6 structural image
Product Name: 2,3,7,8-TETRACHLORODIBENZO-P-DIOXIN
Formula: C12H4Cl4O2
Synonyms: 2,3,7,8-TCDD
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CHEMICAL AND PHYSICAL PROPERTIES

Physical Description 2,3,7,8-tetrachlorodibenzo-p-dioxin (tcdd) appears as white crystals or tan crystalline powder. (NTP, 1992)
Color/Form Colorless needles
Boiling Point Decomposes at 932 °F (NTP, 1992)
Melting Point 563 °F (NTP, 1992)
Flash Point 4 °C (39 °F) - closed cup
Solubility less than 1 mg/mL at 77 °F (NTP, 1992)
Density 1.8 g/cm³
Vapor Pressure 6.4e-10 mmHg at 68 °F ; 0.0000000014 mmHg at 77 °F (NTP, 1992)
LogP log Kow = 6.8
Stability/Shelf Life Changed chemically when exposed in isooctane or n-octanol to UV light.
Decomposition /2,3,7,8-Tetrachlorodibenzo-p-dioxin/ begins to decompose at 500 °C and virtually complete decomposition occurs within 21 seconds at a temp of 800 °C.
Kovats Retention Index 2336
Other Experimental Properties Needles, mp 295 °C; ... crystals from anisol, mp 320-325 °C
Chemical Classes Other Classes -> Halogenated Polyaromatics

SAFETY INFORMATION

Signal word Danger
Pictogram(s)

Flame
Flammables
GHS02

Exclamation Mark
Irritant
GHS07

Health Hazard
GHS08

Environment
GHS09
GHS Hazard Statements H225:Flammable liquids
H304:Aspiration hazard
H315:Skin corrosion/irritation
H336:Specific target organ toxicity,single exposure; Narcotic effects
H373:Specific target organ toxicity, repeated exposure
H410:Hazardous to the aquatic environment, long-term hazard
Precautionary Statement Codes P210:Keep away from heat/sparks/open flames/hot surfaces. — No smoking.
P260:Do not breathe dust/fume/gas/mist/vapours/spray.
P280:Wear protective gloves/protective clothing/eye protection/face protection.
P301+P310:IF SWALLOWED: Immediately call a POISON CENTER or doctor/physician.
P370+P378:In case of fire: Use … for extinction.
P403+P235:Store in a well-ventilated place. Keep cool.

COMPUTED DESCRIPTORS

Molecular Weight 322.0 g/mol
XLogP3 6.4
Hydrogen Bond Donor Count 0
Hydrogen Bond Acceptor Count 2
Rotatable Bond Count 0
Exact Mass 321.893590 g/mol
Monoisotopic Mass 319.896540 g/mol
Topological Polar Surface Area 18.5 Ų
Heavy Atom Count 18
Formal Charge 0
Complexity 259
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

2,3,7,8-tetrachlorodibenzo-p-dioxin (tcdd) appears as white crystals or tan crystalline powder. (NTP, 1992)