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Cas Database |
| Name |
1,3,5-TRICHLOROBENZENE |
EINECS | 203-608-6 |
| CAS No. | 108-70-3 | Density | 1.448 g/cm3 |
| PSA | 0.00000 | LogP | 3.64680 |
| Solubility | Insoluble in water. | Melting Point |
63 °C |
| Formula | C6H3Cl3 | Boiling Point | 211.3 °C at 760 mmHg |
| Molecular Weight | 181.449 | Flash Point | 126.7 °C |
| Transport Information | N/A | Appearance | white to beige crystalline powder |
| Safety | 26-36-36/37-61 | Risk Codes | 20/21/22-36/37/38-38-22-52/53 |
| Molecular Structure |
|
Hazard Symbols |
 Xn, Xi
|
| Synonyms |
Benzene, 1,3,5-trichloro-;sym-trichlorobenzene;s-Trichlorobenzene;1,3,5-trichloro benzene;1,3,5-trichlorobenzol; |
Article Data | 81 |
1,3,5-TRICHLOROBENZENE Synthetic route
Conditions
| Conditions | Yield |
|---|---|
| With radical anion of p,p'-di-tert-butylbiphenyl In tetrahydrofuran at -25℃; Irradiation; | A 2.8% B 97.2% |
- 19752-55-7
1-bromo-3,5-dichlorobenzene
- 108-70-3
1,3,5-trichlorobenzene
Conditions
| Conditions | Yield |
|---|---|
| With chlorine; sodium thiosulfate | 97.2% |
Conditions
| Conditions | Yield |
|---|---|
| With sulfuric acid; hypophosphorous acid; sodium nitrite In water at -5 - 25℃; | 95% |
| With tetrafluoroboric acid; N,N-dimethyl-formamide; sodium nitrite In water at 45℃; for 0.25h; Product distribution; or benzene, room temperature, 3 h; | 94% |
| Stage #1: 2,4,6-trichloroaniline With sulfuric acid Stage #2: With sodium nitrite In water for 0.75h; Cooling with ice; Stage #3: With sodium hypophosphite hydrate In hexane; water at 20℃; Cooling with ice; | 84% |
Conditions
| Conditions | Yield |
|---|---|
| With chloro-trimethyl-silane; N-benzyl-N,N,N-triethylammonium chloride; sodium nitrite In tetrachloromethane 1.) 0 deg C, 1.5 h, 2.) r.t., 14 h; | 95% |
- 14862-52-3
1,3-dibromo-5-chlorobenzene
- 108-70-3
1,3,5-trichlorobenzene
Conditions
| Conditions | Yield |
|---|---|
| With chlorine; sodium thiosulfate In tetrachloromethane | 91% |
- 58-89-9
LINDANE
A
- 108-70-3
1,3,5-trichlorobenzene
B
- 120-82-1
1,2,4-Trichlorobenzene
C
- 87-61-6
1,2,3-trichlorobenzene
Conditions
| Conditions | Yield |
|---|---|
| With ammonia at 25℃; Product distribution; Further Variations:; Reagents; Dehalogenation; | A 5% B 87% C 8% |
| at 25℃; pH=8.32; Kinetics; Product distribution; Further Variations:; pH-values; | |
| With (5,10,15,20-tetrakis(pentafluorophenyl)porphyrinato)iron(III) chloride; tetrabutylammonium perchlorate In N,N-dimethyl-formamide for 4h; Electrolysis; |
Conditions
| Conditions | Yield |
|---|---|
| With tetrafluoroboric acid; hydrogen iodide In acetonitrile at 60℃; for 24h; | A 3% B 86% |
- 634-90-2
1,2,3,5-tetrachlorobenzene
A
- 108-70-3
1,3,5-trichlorobenzene
B
- 120-82-1
1,2,4-Trichlorobenzene
C
- 87-61-6
1,2,3-trichlorobenzene
Conditions
| Conditions | Yield |
|---|---|
| With radical anion of p,p'-di-tert-butylbiphenyl; triethylamine In tetrahydrofuran at 45℃; Irradiation; | A 18.8% B 75.5% C 5.7% |
| With radical anion of p,p'-di-tert-butylbiphenyl; triethylamine In tetrahydrofuran at 45℃; Product distribution; Rate constant; Mechanism; Irradiation; radical anion of naphthalene, different temperatures, without Et3N; | A 18.8% B 75.5% C 5.7% |
| With radical anion of p,p'-di-tert-butylbiphenyl In tetrahydrofuran at 45℃; Irradiation; | A 59.2% B 40.5% C 0.3% |
| In acetonitrile at 40℃; Product distribution; Mechanism; Quantum yield; Irradiation; in the presence of triethylamine; | A 18.77 % Chromat. B 75.45 % Chromat. C 5.78 % Chromat. |
| With sodium bis(2-methoxyethoxy)aluminium dihydride In toluene at 70℃; Rate constant; relative reactivity in dehalogenation; |
A
- 108-70-3
1,3,5-trichlorobenzene
B
- 33979-03-2
2,2',4,4',6,6'-Hexachlorobiphenyl
C
- 134253-68-2
2,4,6-trichlorobenzenediazohydroxide
D
- 23914-43-4, 18490-44-3
2,2',4,4',6,6'-Hexachlor-azobenzen
Conditions
| Conditions | Yield |
|---|---|
| With 2,2,2-trifluoroethanol at 34℃; for 24h; Irradiation; Further byproducts given; | A 51.4% B 12.4% C 1.5% D 15.3% |
A
- 108-70-3
1,3,5-trichlorobenzene
B
- 33979-03-2
2,2',4,4',6,6'-Hexachlorobiphenyl
C
- 134253-68-2
2,4,6-trichlorobenzenediazohydroxide
D
- 23914-43-4, 18490-44-3
2,2',4,4',6,6'-Hexachlor-azobenzen
Conditions
| Conditions | Yield |
|---|---|
| With 2,2,2-trifluoroethanol at 34℃; for 24h; Product distribution; influence of magnetic field; | A 51.4% B 12.4% C 1.5% D 15.3% E n/a |
...Expand
1,3,5-TRICHLOROBENZENE Chemical Properties
1,3,5-TRICHLOROBENZENE(108-70-3) is the chemical compound with the formula C6H3Cl3.Its molar weight is 181.45g/mol.
1,3,5-TRICHLOROBENZENE(108-70-3) is also named SYM-TRICHLOROBENZENE;1,3,5-trichloro-benzen;ai3-22031;Benzene,1,3,5-trichloro-;I,3,5-TrichlorbenzolVW,16;s-Trichlorobenzene;trichloro-1,3,5benzene;1,3,5-TCB
Meiting Point: 63 oC
Boiling Point: 208 oC(lit.)
Flash Point: 260 oF
Storage temp.: 0-6oC
Stability: Stable. Incompatible with acids, strong oxidizing agents.
Index of Refraction: 1.567
Molar Refractivity: 40.93 cm3
Molar Volume: 125.2 cm3
Surface Tension: 39.9 dyne/cm
Density: 1.448 g/cm3
Enthalpy of Vaporization: 42.93 kJ/mol
Vapour Pressure: 0.267 mmHg at 25oC
The chemical structure of 1,3,5-TRICHLOROBENZENE(108-70-3) is
.
1,3,5-TRICHLOROBENZENE(108-70-3) is also named SYM-TRICHLOROBENZENE;1,3,5-trichloro-benzen;ai3-22031;Benzene,1,3,5-trichloro-;I,3,5-TrichlorbenzolVW,16;s-Trichlorobenzene;trichloro-1,3,5benzene;1,3,5-TCB
Meiting Point: 63 oC
Boiling Point: 208 oC(lit.)
Flash Point: 260 oF
Storage temp.: 0-6oC
Stability: Stable. Incompatible with acids, strong oxidizing agents.
Index of Refraction: 1.567
Molar Refractivity: 40.93 cm3
Molar Volume: 125.2 cm3
Surface Tension: 39.9 dyne/cm
Density: 1.448 g/cm3
Enthalpy of Vaporization: 42.93 kJ/mol
Vapour Pressure: 0.267 mmHg at 25oC
The chemical structure of 1,3,5-TRICHLOROBENZENE(108-70-3) is
.1,3,5-TRICHLOROBENZENE Uses
1,3,5-TRICHLOROBENZENE(108-70-3) is used as intermediate of medicine and pesticide.
1,3,5-TRICHLOROBENZENE Toxicity Data With Reference
| 1. | dlt-oin-oin-par 10 ppm | EVETBX Environmental Entomology. 2 (1973),1029. | ||
| 2. | dlt-oin-oin-skn 10 ppm | EVETBX Environmental Entomology. 2 (1973),1029. | ||
| 3. | mnt-mus-ipr 425 mg/kg/24H | MUTAEX Mutagenesis. 2 (1987),111. | ||
| 4. | orl-rat LD50:800 mg/kg | 48RKAL Industrial and Environmental Xenobiotics: Metabolism and Pharmacokinetics of Organic Chemicals and Metals, Proceedings of an International Conference, Prague ,Gut, I., et al.,Berlin, Fed. Rep, Ger..: Springer-Verlag,1981,389. | ||
| 5. | orl-mus LD50:3350 mg/kg | NTIS** National Technical Information Service. (Springfield, VA 22161) (Formerly U.S. Clearinghouse for Scientific and Technical Information) UCRL-13701 . | ||
| 6. | ipr-mus LD50:2260 mg/kg | MUTAEX Mutagenesis. 2 (1987),111. |
1,3,5-TRICHLOROBENZENE Consensus Reports
Reported in EPA TSCA Inventory.
1,3,5-TRICHLOROBENZENE Safety Profile
Moderately toxic by ingestion and intraperitoneal routes. Mutation data reported. When heated to decomposition it emits toxic vapors of Cl−.
Hazard Codes:
Xn,Xi
Risk Statements: 20/21/22-36/37/38-38-22-52/53
20/21/22: Harmful by inhalation, in contact with skin and if swallowed
36/37/38: Irritating to eyes, respiratory system and skin
38: Irritating to the skin
22: Harmful if swallowed
52/53: Harmful to aquatic organisms, may cause long-term adverse effects in the aquatic environment
Safety Statements: 26-36-36/37-61
26: In case of contact with eyes, rinse immediately with plenty of water and seek medical advice
36: Wear suitable protective clothing
36/37: Wear suitable protective clothing and gloves
61: Avoid release to the environment. Refer to special instructions safety data sheet
RIDADR: 3077
WGK Germany: 3
RTECS: DC2100100
Hazard Note: Harmful/Irritant
HazardClass: 9
PackingGroup: III
Hazardous Substances Data: 108-70-3(Hazardous Substances Data) .
Hazard Codes:
Xn,Xi Risk Statements: 20/21/22-36/37/38-38-22-52/53
20/21/22: Harmful by inhalation, in contact with skin and if swallowed
36/37/38: Irritating to eyes, respiratory system and skin
38: Irritating to the skin
22: Harmful if swallowed
52/53: Harmful to aquatic organisms, may cause long-term adverse effects in the aquatic environment
Safety Statements: 26-36-36/37-61
26: In case of contact with eyes, rinse immediately with plenty of water and seek medical advice
36: Wear suitable protective clothing
36/37: Wear suitable protective clothing and gloves
61: Avoid release to the environment. Refer to special instructions safety data sheet
RIDADR: 3077
WGK Germany: 3
RTECS: DC2100100
Hazard Note: Harmful/Irritant
HazardClass: 9
PackingGroup: III
Hazardous Substances Data: 108-70-3(Hazardous Substances Data) .
1,3,5-TRICHLOROBENZENE Standards and Recommendations
DFG MAK: 5 ppm
1,3,5-TRICHLOROBENZENE Specification
(1)It must be separated from strong oxidants and keep in a well-ventilated room.
(2)When spilled,sweep it into containers; if appropriate, moisten first to prevent dusting. Carefully collect remainder, then remove to safe place. Do NOT let this chemical enter the environment.
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1,3,5-Trichlorobenzene
