ChemicalBook > CAS DataBase List > 1,2,3-Trimethylbenzene

1,2,3-Trimethylbenzene

Product Name
1,2,3-Trimethylbenzene
CAS No.
526-73-8
Chemical Name
1,2,3-Trimethylbenzene
Synonyms
benzene,1,2,3-trimethyl-;80.0%;HEMELLITOL;Hemimelithol;hemimellitol;HEMIMELLITINE;HEMIMELLITENE;1.2.3-Trimethy;1,2,3-TrimethyL;1,2,3-Trimethylbenze
CBNumber
CB6853732
Molecular Formula
C9H12
Formula Weight
120.19
MOL File
526-73-8.mol
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1,2,3-Trimethylbenzene Property

Melting point:
−25 °C(lit.)
Boiling point:
175-176 °C(lit.)
Density 
0.894 g/mL at 25 °C(lit.)
vapor density 
4.15 (vs air)
vapor pressure 
3.4 mm Hg ( 37.7 °C)
refractive index 
n20/D 1.513(lit.)
Flash point:
119 °F
solubility 
Soluble in acetone, alcohol, benzene, and ether (Weast, 1986)
pka
>14 (Schwarzenbach et al., 1993)
color 
Colorless to Light yellow
Odor Threshold
0.032ppm
Water Solubility 
65.51mg/L(25 ºC)
BRN 
1903410
Henry's Law Constant
3.18 at 25 °C (approximate - calculated from water solubility and vapor pressure)
Exposure limits
NIOSH REL: TWA 25 ppm (125 mg/m3); ACGIH TLV: TWA for mixed isomers 25 ppm (adopted).
Dielectric constant
2.6600000000000001
Stability:
Stable. Flammable. Incompatible with strong oxidizing agents.
LogP
3.660
CAS DataBase Reference
526-73-8(CAS DataBase Reference)
NIST Chemistry Reference
Benzene, 1,2,3-trimethyl-(526-73-8)
EPA Substance Registry System
1,2,3-Trimethylbenzene (526-73-8)
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Safety

Hazard Codes 
Xi
Risk Statements 
10-37-36/37/38
Safety Statements 
16-26
RIDADR 
UN 3295 3/PG 3
OEB
A
OEL
TWA: 25 ppm (125 mg/m3)
WGK Germany 
3
RTECS 
DC3300000
Autoignition Temperature
878 °F
HazardClass 
3.2
PackingGroup 
III
HS Code 
2902900000
Hazardous Substances Data
526-73-8(Hazardous Substances Data)
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Hazard and Precautionary Statements (GHS)

Symbol(GHS)
Signal word
Warning
Hazard statements

H226Flammable liquid and vapour

H315Causes skin irritation

H319Causes serious eye irritation

H335May cause respiratory irritation

Precautionary statements

P210Keep away from heat/sparks/open flames/hot surfaces. — No smoking.

P302+P352IF ON SKIN: wash with plenty of soap and water.

P305+P351+P338IF IN EYES: Rinse cautiously with water for several minutes. Remove contact lenses, if present and easy to do. Continuerinsing.

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N-Bromosuccinimide Price

Sigma-Aldrich
Product number
T73202
Product name
1,2,3-Trimethylbenzene
Packaging
5ml
Price
$59.3
Updated
2024/03/01
Sigma-Aldrich
Product number
45935
Product name
1,2,3-Trimethylbenzene
Purity
analytical standard
Packaging
250mg
Price
$44.5
Updated
2024/03/01
TCI Chemical
Product number
T0468
Product name
1,2,3-Trimethylbenzene
Purity
>80.0%(GC)
Packaging
5mL
Price
$35
Updated
2024/03/01
TCI Chemical
Product number
T0468
Product name
1,2,3-Trimethylbenzene
Purity
>80.0%(GC)
Packaging
25mL
Price
$126
Updated
2024/03/01
Sigma-Aldrich
Product number
T73202
Product name
1,2,3-Trimethylbenzene
Packaging
50ml
Price
$172
Updated
2024/03/01
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1,2,3-Trimethylbenzene Chemical Properties,Usage,Production

Chemical Properties

colourless liquid

Chemical Properties

Trimethylbenzenes exists in three isomeric forms. All isomers are clear, colorless liquids with a distinctive, aromatic odor.

Physical properties

Clear, colorless, flammable liquid with an aromatic odor similar to propylbenzene, ethylbenzenes, or xylenes.

Uses

Raw material for chemical synthesis.

Definition

ChEBI: A trimethylbenzene carrying methyl groups at positions 1, 2 and 3. It has been found in Centaurium erythraea.

Synthesis Reference(s)

Journal of the American Chemical Society, 62, p. 2639, 1940 DOI: 10.1021/ja01867a017
Organic Syntheses, Coll. Vol. 4, p. 508, 1963

Hazard

Combustible. Central nervous system impairment, asthma, and hematologic effects.

Safety Profile

Mildly toxic by ingestion, Flammable liquid when exposed to heat, sparks, or flame. To fight fire, use water spray, mist, dry chemical, CO2, foam. When heated to decomposition it emits acrid smoke and irritating fumes.

Potential Exposure

(1,2,3-and 1,2,4-isomers): These materials are used as solvents and in dye and perfume manufacture. The 1,2,3-isomer is used as raw material in chemical synthesis and as an UV stabilizer. The 1,2,4-isomer is used as the raw material for trimellitic anhydride manufacture. These compounds are found in diesel engine exhaust fumes.

Source

Detected in distilled water-soluble fractions of 87 octane gasoline (0.30 mg/L), 94 octane gasoline (0.81 mg/L), Gasohol (0.80 mg/L), No. 2 fuel oil (0.22 mg/L), diesel fuel (0.09 mg/L), and military jet fuel JP-4 (0.19 mg/L) (Potter, 1996).
Thomas and Delfino (1991) equilibrated contaminant-free groundwater collected from Gainesville, FL with individual fractions of three individual petroleum products at 24–25 °C for 24 h. The aqueous phase was analyzed for organic compounds via U.S. EPA approved test method 602. Average 1,2,3-trimethylbenzene concentrations detected in water-soluble fractions of unleaded gasoline, kerosene, and diesel fuel were 1.219, 0.405, and 0.118 mg/L, respectively.
When the authors analyzed the aqueous-phase via U.S. EPA approved test method 610, average 1,2,3-trimethylbenzene concentrations in water-soluble fractions of unleaded gasoline, kerosene, and diesel fuel were smaller, i.e., 742, 291, and 105 μg/L, respectively.

Environmental Fate

Photolytic. Glyoxal, methylglyoxal, and biacetyl were produced from the photooxidation of 1,2,3-trimethylbenzene by OH radicals in air at 25 °C (Tuazon et al., 1986a). The rate constant for the reaction of 1,2,3-trimethylbenzene and OH radicals at room temperature was 1.53 x 10-11 cm3/molecule?sec (Hansen et al., 1975). A rate constant of 1.49 x 10-8 L/molecule?sec was reported for the reaction of 1,2,3-trimethylbenzene with OH radicals in the gas phase (Darnall et al., 1976). Similarly, a room temperature rate constant of 3.16 x 10-11 cm3/molecule?sec was reported for the vapor-phase reaction of 1,2,3-trimethylbenzene with OH radicals (Atkinson, 1985). At 25 °C, a rate constant of 2.69 x 10-11 cm3/molecule?sec was reported for the same reaction (Ohta and Ohyama, 1985). 2,3-Butanedione was the only products identified from the OH radical-initiated reaction of 1,2,4-trimethylbenzene in the presence of nitrogen dioxide. The amount of 2,3- butanedione formed decreased with increased concentration of nitrogen dioxide (Bethel et al., 2000).
Chemical/Physical. 1,2,3-Trimethylbenzene will not hydrolyze because it does not contain a hydrolyzable group (Kollig, 1993).

Shipping

UN3295 Hydrocarbons, liquid, n.o.s., Hazard Class: 3; Labels: 3-Flammable liquid. UN1993 Flammable liquids, n.o.s., Hazard Class: 3; Labels: 3-Flammable liquid, Technical Name Required. 1,3,5-Trimethylbenzene; UN2325, Hazard Class: 3; Labels: 3-Flammable liquid. 1,2,4-Trimethylbenzene:

Incompatibilities

Vapors may form explosive mixture with air. Incompatible with oxidizers (chlorates, nitrates, peroxides, permanganates, perchlorates, chlorine, bromine, fluorine, etc.); contact may cause fires or explosions. Keep away from alkaline materials, strong bases, strong acids, oxoacids, epoxides.

Waste Disposal

Dissolve or mix the material with a combustible solvent and burn in a chemical incinerator equipped with an afterburner and scrubber. All federal, state, and local environmental regulations must be observed.

1,2,3-Trimethylbenzene Preparation Products And Raw materials

Raw materials

Preparation Products

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View Lastest Price from 1,2,3-Trimethylbenzene manufacturers

Zhuozhou Wenxi import and Export Co., Ltd
Product
1,2,3-Trimethylbenzene 526-73-8
Price
US $15.00-10.00/KG
Min. Order
1KG
Purity
99%+ HPLC
Supply Ability
Monthly supply of 1 ton
Release date
2021-07-11
Zhuozhou Wenxi import and Export Co., Ltd
Product
1,2,3-Trimethylbenzene 526-73-8
Price
US $15.00-10.00/KG
Min. Order
1KG
Purity
99%+ HPLC
Supply Ability
Monthly supply of 1 ton
Release date
2021-07-09
Zhuozhou Wenxi import and Export Co., Ltd
Product
1,2,3-Trimethylbenzene 526-73-8
Price
US $15.00-10.00/KG
Min. Order
1KG
Purity
99%+ HPLC
Supply Ability
Monthly supply of 1 ton
Release date
2021-06-27

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