| Identification | More | [Name]
1,2,3-Trichlorobenzene | [CAS]
87-61-6 | [Synonyms]
1,2,3-TCB
1,2,3-TRICHLOROBENZENE
VIC-TRICHLOROBENZENE
1,2,3-trcb
1,2,3-trichloro-benzen
1,2,6-Trichlorobenzene
ai3-15516
benzene,1,2,3-trichloro-
trichlorobenzene(non-specificname)
Trichlorobenzene,1,2,3-
1,2,3-Trichlorobnzene
1,2,3-TRICHLOROBENZENE, 1X1ML, MEOH, 500 0UG/ML
1,2,3-TRICHLOROBENZENE, 1000MG, NEAT
1,2,3-TRICHLOROBENZENE PESTANAL
1,2,3-Trichlorobenzene,99%
1,2,3-trichlorobenzene solution
1,2,3-Trichlorbenzol
Trichlorbenzole
1,2,3-TRICHLORBENZENE
1,2,3-Trichlorobenzene (1mg/ml in Methanol) [for Water Analysis] | [EINECS(EC#)]
201-757-1 | [Molecular Formula]
C6H3Cl3 | [MDL Number]
MFCD00000537 | [Molecular Weight]
181.45 | [MOL File]
87-61-6.mol |
| Chemical Properties | Back Directory | [Appearance]
White crystalline | [Melting point ]
51-53 °C (lit.) | [Boiling point ]
218-219 °C (lit.) | [density ]
1,69 g/cm3 | [vapor density ]
6.25 (vs air)
| [vapor pressure ]
0.07 mm Hg ( 25 °C)
| [refractive index ]
1.5693 (estimate) | [Fp ]
260 °F
| [storage temp. ]
0-6°C | [solubility ]
0.02g/l | [form ]
neat | [color ]
White crystals or platelets | [explosive limit]
2.5-6.6%(V) | [Water Solubility ]
INSOLUBLE | [Thermal Conductivity]
0.108 W/(m·K) at 25 ℃ | [Merck ]
14,9630 | [BRN ]
956882 | [Henry's Law Constant]
8.36, 10.3, 13.2, 20.6, and 26.5 at 2.0, 6.0, 10.0, 18.0, and 25.0 °C, respectively (EPICS-SPME,
Dewulf et al., 1999) | [InChI]
1S/C6H3Cl3/c7-4-2-1-3-5(8)6(4)9/h1-3H | [InChIKey]
RELMFMZEBKVZJC-UHFFFAOYSA-N | [SMILES]
Clc1cccc(Cl)c1Cl | [LogP]
4.139 at 25℃ | [Uses]
Organic intermediate. | [CAS DataBase Reference]
87-61-6(CAS DataBase Reference) | [NIST Chemistry Reference]
Benzene, 1,2,3-trichloro-(87-61-6) | [EPA Substance Registry System]
87-61-6(EPA Substance) |
| Safety Data | Back Directory | [Hazard Codes ]
Xn,T | [Risk Statements ]
R22:Harmful if swallowed.
R36/37/38:Irritating to eyes, respiratory system and skin .
R38:Irritating to the skin.
R39/23/24/25:Toxic: danger of very serious irreversible effects through inhalation, in contact with skin and if swallowed .
R23/24/25:Toxic by inhalation, in contact with skin and if swallowed .
R52/53:Harmful to aquatic organisms, may cause long-term adverse effects in the aquatic environment . | [Safety Statements ]
S36/37:Wear suitable protective clothing and gloves .
S26:In case of contact with eyes, rinse immediately with plenty of water and seek medical advice .
S45:In case of accident or if you feel unwell, seek medical advice immediately (show label where possible) .
S61:Avoid release to the environment. Refer to special instructions safety data sheet .
S36:Wear suitable protective clothing . | [RIDADR ]
UN 3077 9/PG 3
| [WGK Germany ]
3
| [RTECS ]
DC2095000
| [Autoignition Temperature]
1059 °F | [TSCA ]
Yes | [REACH Registrations]
Active | [HazardClass ]
9 | [PackingGroup ]
III | [HS Code ]
29036990 | [Storage Class]
11 - Combustible Solids | [Hazard Classifications]
Aquatic Acute 1
Aquatic Chronic 1
Skin Sens. 1B | [Hazardous Substances Data]
87-61-6(Hazardous Substances Data) | [Toxicity]
LC50 2,177 to 3,084 μg/L (soil porewater concentration) for earthworm (Eisenia andrei) and
2,540 to 3,084 μg/L (soil porewater concentration) for earthworm (Lumbricus rubellus) (Van
Gestel and Ma, 1993). |
| Raw materials And Preparation Products | Back Directory | [Raw materials]
1,2,4-Trichlorobenzene-->1,3,5-Trichlorobenzene | [Preparation Products]
1,2,4-Trichlorobenzene-->1,3,5-Trichlorobenzene-->2,3-Dichlorophenol-->2,3.4-Trichlorobenzene sulfonic acid-->3,4-Dichloro-2-hydroxybenzenefulfonic acid-->1-(2,3-Dichlorophenyl)-piperazine-->2,3,4-Trichlorobenzoic acid-->Sodium 2,3,4-trichlorobenzenesulfonate-->2,3-Dichlorobenzoic acid-->3,4,5-Trichloro-benzoicacid-->2,3-Dichlorothiophenol-->2,2',3,3',4,4',6-Heptachlorobiphenyl-->1,2,4,5-BenzenetetraMine-->1,3-Dichloro-2-fluorobenzene-->1,2,3-Trifluorobenzene-->Acetic acid, (2,3-dichlorophenoxy)-, ethyl ester |
| Hazard Information | Back Directory | [General Description]
A white solid with a sharp chlorobenzene odor. Insoluble in water and denser than water. Hence sinks in water. Melting point 63-64°C (145-147°F). | [Reactivity Profile]
1,2,3-TRICHLOROBENZENE(87-61-6) can react with oxidizing agents. . May emit toxic hydrogen chloride and phosgene gases in fire. | [Air & Water Reactions]
Insoluble in water. | [Health Hazard]
Inhalation may cause irritation of respiratory tract. Irritating to the eyes. May redden skin on contact. Ingestion may cause liver damage. | [Description]
Trichlorobenzenes (TCBs) are synthetic chemicals that
occur in three different isomeric forms. The three chlorinated
cyclic aromatic isomers are 1,2,3-trichlorobenzene (1,2,3-TCB),
1,2,4-trichlorobenzene (1,2,4-TCB), and 1,3,5-trichlorobenzene
(1,3,5-TCB). 1,2,4-TCB is one of the 188 chemicals designated
as a hazardous air pollutant under the Clean Air Act. | [Chemical Properties]
White crystalline | [Definition]
ChEBI: 1,2,3-trichlorobenzene is a trichlorobenzene carrying chloro substituents at positions 1, 2 and 3. | [Environmental Fate]
Biological. Under aerobic conditions, soil microbes are capable of degrading 1,2,3-
trichlorobenzene to 1,2- and 1,3-dichlorobenzene and carbon dioxide (Kobayashi and Rittman,
1982). A mixed culture of soil bacteria or a Pseudomonas sp. transformed 1,2,3-trichlorobenzene
to 2,3,4-, 3,4,5-, and 2,3,6-trichlorophenol (Ballschiter and Scholz, 1980).
In an enrichment culture derived from a contaminated site in Bayou d’Inde, LA, 1,2,3-
trichlorobenzene underwent reductive dechlorination to 1,2- and 1,3-dichlorobenzene at relative
molar yields of 1 and 99%, respectively. The maximum dechlorination rate, based on the
recommended Michaelis-Menten model, was 60 nM/d (Pavlostathis and Prytula, 2000).
Photolytic. The sunlight irradiation of 1,2,3-trichlorobenzene (20 g) in a 100-mL borosilicate
glass-stoppered Erlenmeyer flask for 56 d yielded 32 ppm pentachlorobiphenyl (Uyeta et al.,
1976).
Chemical/Physical. At 70.0 °C and pH values of 3.07, 7.13, and 9.80, the hydrolysis half-lives
were calculated to be 19.2, 15.0, and 34.4 d, respectively (Ellington et al., 1986).
Emits toxic chloride fumes when heated to decomposition. | [Purification Methods]
Crystallise it from EtOH. [Beilstein 5 IV 664.] | [Toxicity evaluation]
The liver is themain target of trichlorobenzenes irrespective of
the route of exposure. The mechanisms of liver toxicity
induced by these chemicals have not been illustrated. It might
involve intermediate arene oxides formed during initial
transformation to trichlorophenols. In addition, exposure
to 1,2,4-TCB induced porphyria in rats by inducing δ-aminolevulinic
acid (ALA) synthetase, a rate-limiting enzyme
in the biosynthesis of heme, and also heme oxygenase, a ratelimiting
enzyme in the degradation of heme synthetase, and
therefore increasing heme production. | [Toxics Screening Level]
The initial threshold screening level (ITSL) for 1 ,2,3-Trichlorobenzene is 27 μg/m3 based on a 24-hour averaging time. |
| Spectrum Detail | Back Directory | [Spectrum Detail]
1,2,3-Trichlorobenzene(87-61-6)MS
1,2,3-Trichlorobenzene(87-61-6)1HNMR
1,2,3-Trichlorobenzene(87-61-6)13CNMR
1,2,3-Trichlorobenzene(87-61-6)IR1
1,2,3-Trichlorobenzene(87-61-6)IR2
1,2,3-Trichlorobenzene(87-61-6)IR3
1,2,3-Trichlorobenzene(87-61-6)Raman
|
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Alfa Aesar
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Energy Chemical
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Maya High Purity Chemicals
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021-021-021-67601398-809-809-809 15221380277 |
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