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611-06-3

611-06-3 structural image
Product Name: 2,4-Dichloronitrobenzene
Formula: C6H3Cl2NO2
Synonyms: 1,3-Dichloro-4-nitrobenzene;2,4-Dichloro-1-nitrobenzene, 1-Nitro-2.4-dichlorine benzene;asym.-Nitro-m-dichlorobenzene
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CHEMICAL AND PHYSICAL PROPERTIES

Physical Description 2,4-dichloronitrobenzene appears as light yellow needles or amber crystalline solid. (NTP, 1992)
Color/Form Crystallizes as pale yellow needles from ethanol.
Boiling Point 496 °F at 760 mmHg (NTP, 1992)
Melting Point 84 to 90 °F (NTP, 1992)
Flash Point greater than 235 °F (NTP, 1992)
Solubility less than 0.1 mg/mL at 61 °F (NTP, 1992)
Density 1.551 at 172 °F (NTP, 1992) - Denser than water; will sink
Vapor Density Relative vapor density (air = 1): 6.6
Vapor Pressure 0.01 [mmHg]
LogP log Kow = 3.07
Autoignition Temperature 500 °C
Refractive Index Index of refraction: 1.5512 at 70 °C/alpha
Kovats Retention Index 1334.4 1322 1322
Chemical Classes Nitrogen Compounds -> Nitros, Aromatic

SAFETY INFORMATION

Signal word Danger
Pictogram(s)

Skull and Crossbones
Acute Toxicity
GHS06

Health Hazard
GHS08

Environment
GHS09
GHS Hazard Statements H302:Acute toxicity,oral
H311:Acute toxicity,dermal
H317:Sensitisation, Skin
H341:Germ cell mutagenicity
H350:Carcinogenicity
H411:Hazardous to the aquatic environment, long-term hazard
Precautionary Statement Codes P202:Do not handle until all safety precautions have been read and understood.
P273:Avoid release to the environment.
P280:Wear protective gloves/protective clothing/eye protection/face protection.
P301+P312:IF SWALLOWED: call a POISON CENTER or doctor/physician IF you feel unwell.
P308+P313:IF exposed or concerned: Get medical advice/attention.

COMPUTED DESCRIPTORS

Molecular Weight 192.00 g/mol
XLogP3 3.1
Hydrogen Bond Donor Count 0
Hydrogen Bond Acceptor Count 2
Rotatable Bond Count 0
Exact Mass 190.9540837 g/mol
Monoisotopic Mass 190.9540837 g/mol
Topological Polar Surface Area 45.8 Ų
Heavy Atom Count 11
Formal Charge 0
Complexity 159
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

2,4-dichloronitrobenzene appears as light yellow needles or amber crystalline solid. (NTP, 1992)