ChemicalBook
Chinese Japanese Germany Korea

1,2,4-Trimethylbenzene

Description Toxicity
1,2,4-Trimethylbenzene
1,2,4-Trimethylbenzene structure
CAS No.
95-63-6
Chemical Name:
1,2,4-Trimethylbenzene
Synonyms
PSC;pseudo;ps-Cumene;PSI-CUMENE;PSEUDOCUMOL;PSEUDOCUMENE;1.2.4-Trimethy;1,2,4-TrimethyL;TRIMETHYLBENZENE;PSEUDOCUMENE(SG)
CBNumber:
CB0854702
Molecular Formula:
C9H12
Formula Weight:
120.19
MOL File:
95-63-6.mol

1,2,4-Trimethylbenzene Properties

Melting point:
-44 °C
Boiling point:
168 °C(lit.)
Density 
0.876 g/mL at 20 °C(lit.)
vapor density 
4.1 (vs air)
vapor pressure 
4.5 mm Hg ( 37.7 °C)
refractive index 
n20/D 1.504(lit.)
Flash point:
120 °F
storage temp. 
Store below +30°C.
solubility 
0.057g/l
form 
Liquid
pka
>14 (Schwarzenbach et al., 1993)
color 
Clear colorless
explosive limit
0.8-7%(V)
Odor Threshold
0.12ppm
Water Solubility 
Soluble in alcohol, benzene and ether. Slightly soluble in water
Merck 
14,7915
BRN 
1903005
Henry's Law Constant
6.946, 11.202, and 15.702 at 27.0, 35.0, and 45.0 °C, respectively (dynamic headspace, Hansen et al., 1995)
Exposure limits
NIOSH REL: TWA 25 ppm (125 mg/m3); ACGIH TLV: TWA for mixed isomers 25 ppm (adopted).
Stability:
Stable. Incompatible with strong oxidizing agents. Flammable. May form explosive mixtures with air.
InChIKey
GWHJZXXIDMPWGX-UHFFFAOYSA-N
CAS DataBase Reference
95-63-6(CAS DataBase Reference)
EWG's Food Scores
2
FDA UNII
34X0W8052F
EPA Substance Registry System
1,2,4-Trimethylbenzene (95-63-6)
SAFETY
  • Risk and Safety Statements
Symbol(GHS) 
GHS02,GHS07,GHS08,GHS09
Signal word  Danger
Hazard statements  H226-H304-H315-H319-H332-H335-H411-H401
Precautionary statements  P210-P303+P361+P353-P405-P501a-P261-P273-P301+P310-P305+P351+P338-P331
Hazard Codes  Xn,N,F,Xi,T
Risk Statements  10-20-36/37/38-51/53-39/23/24/25-23/24/25-11-65
Safety Statements  26-61-45-36/37-16-7-62
RIDADR  UN 3295 3/PG 3
WGK Germany  2
RTECS  DC3325000
Autoignition Temperature 959 °F
Hazard Note  Irritant/Flammable
TSCA  Yes
HazardClass  3
PackingGroup  III
HS Code  29029090
Toxicity LD50 i.p. in male, female mice (mg/kg): 5000, 4100 (Janik-Spiechowicz)
NFPA 704
2
0 0

1,2,4-Trimethylbenzene price More Price(16)

Manufacturer Product number Product description CAS number Packaging Price Updated Buy
Sigma-Aldrich 45996 1,2,4-Trimethylbenzene analytical standard 95-63-6 250mg $14.8 2021-03-22 Buy
Sigma-Aldrich 8.14505 1,2,4-Trimethylbenzene for synthesis 95-63-6 100 mL $18.41 2021-03-22 Buy
Sigma-Aldrich 47324 1,2,4-Trimethylbenzene analytical standard 95-63-6 1000 mg $28.8 2021-03-22 Buy
Sigma-Aldrich 8.14505 1,2,4-Trimethylbenzene for synthesis 95-63-6 500 mL $36.81 2021-03-22 Buy
Sigma-Aldrich T73601 1,2,4-Trimethylbenzene 98% 95-63-6 2l $121 2021-03-22 Buy

1,2,4-Trimethylbenzene Chemical Properties,Uses,Production

Description

1,2,4-Trimethylbenzene (mesitylene) is an aromatic hydrocarbon compound commonly present in commercial solvents encompassing their boiling range. Mesitylene are the most common isomer used in commercial applications. Aromatic hydrocarbons in hydrocarbon solvents are predominantly alkylated one ring structures as well as two aromatic ring structures which may also be alkylated.

Toxicity

Acute toxicity studies (oral, dermal and inhalation routes of exposure) have been conducted in rats. Oral LD50 values of greater than 5000 mg/kg have been reported. For solvent products containing predominantly mixed C9 aromatic hydrocarbons, oral LD50 values have been reported as greater than 6880 mg/kg (males) and greater than 3440 mg/kg (females). LC50 values of 18,000 mg/m3 was reported for 1,2,4-TMB. For C9 aromatic solvents, the LC50 was greater than 10,200 mg/m3 (Shell Research Laboratory, 1976, unpublished study). One dermal acute study showed an LD50 value of greater than 3440 mg/kg for a C9 aromatic solvent (Shellsol A, a highly aromatic solvent boiling in the white spirit range, consisting of primarily C9 isomers particularly TMBs)

Chemical Properties

colourless liquid

Physical properties

Colorless liquid with a slight aromatic odor. A detection odor threshold concentration of 12 mg/m3 (2.4 ppmv) was experimentally determined by Dravnieks (1974).

Uses

Sterilizing catgut by heating one hour at 160°; solvent in manufacture of dyes, perfumes and resins. Solvent for liquid scintillation counting solutions.

Definition

ChEBI: A trimethylbenzene carrying methyl groups at positions 1, 2 and 4.

Synthesis Reference(s)

Journal of the American Chemical Society, 73, p. 766, 1951 DOI: 10.1021/ja01146a079
Chemical and Pharmaceutical Bulletin, 34, p. 540, 1986 DOI: 10.1248/cpb.34.540

General Description

A liquid. Flash point near 130°F. Less dense than water and insoluble in water. Vapors irritate eyes, throat, and nose. Used in dyes and pharmaceuticals.

Air & Water Reactions

Insoluble in water.

Reactivity Profile

1,2,4-Trimethylbenzene is incompatible with the following: Oxidizers, nitric acid .

Hazard

Moderate fire risk. Central nervous system depressant, irritant to mucous membranes. Asthma and hematologic effects.

Health Hazard

Harmful if inhaled or swallowed. Vapor or mist is irritating to the eyes, mucous membrane and upper respiratory tract. Prolonged contact can cause dermatitis, nausea, headache, dizziness, and narcotic effect.

Safety Profile

Moderately toxic by intraperitoneal route. Mildly toxic by inhalation. Can cause central nervous system depression, anemia, bronchitis. Flammable liquid when exposed to heat, sparks, or flame. To fight fire, use foam, alcohol foam, mist. Emitted from modern building materials (CENEAR 69,22,91). When heated to decomposition it emits acrid smoke and irritating fumes.

Source

Detected in distilled water-soluble fractions of 87 octane gasoline (1.11 mg/L), 94 octane gasoline (3.11 mg/L), Gasohol (2.90 mg/L), No. 2 fuel oil (0.51 mg/L), jet fuel A (0.44 mg/L), diesel fuel (0.39 mg/L), and military jet fuel JP-4 (0.39 mg/L) (Potter, 1996). Schauer et al. (1999) reported 1,2,4-trimethylbenzene in a diesel-powered medium-duty truck exhaust at an emission rate of 880 μg/km.
California Phase II reformulated gasoline contained 1,2,4-trimethylbenzene at a concentration of 24.6 g/kg. Gas-phase tailpipe emission rates from gasoline-powered automobiles with and without catalytic converters were 5.72 and 602 mg/km, respectively (Schauer et al., 2002).
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 1,2,4-trimethylbenzene concentrations reported in water-soluble fractions of unleaded gasoline, kerosene, and diesel fuel were 1.952, 0.478, and 0.130 mg/L, respectively.
When the authors analyzed the aqueous-phase via U.S. EPA approved test method 610, average 1,2,4-trimethylbenzene concentrations in water-soluble fractions of unleaded gasoline, kerosene, and diesel fuel were generally greater, i.e., 1.968, 0.401, and 0.146 mg/L, respectively.
Drinking water standard: No MCLGs or MCLs have been proposed (U.S. EPA, 2000).

Environmental Fate

Biological. In anoxic groundwater near Bemidji, MI, 1,2,4-trimethylbenzene anaerobically biodegraded to the intermediate 3,4-dimethylbenzoic acid and the tentatively identified compounds 2,4- and/or 2,5-dimethylbenzoic acid (Cozzarelli et al., 1990).
Photolytic. Glyoxal, methylglyoxal, and biacetyl were produced from the photooxidation of 1,2,4-trimethylbenzene by OH radicals in air at 25 °C (Tuazon et al., 1986a). A rate constant of 2.0 x 10-8 L/molecule?sec was reported for the reaction of 1,2,4-trimethylbenzene with OH radicals in the gas phase (Darnall et al., 1976). Similarly, the rate constants for the reaction of 1,2,4- trimethylbenzene and OH radicals at room temperature were 3.35 x 10-11 (Hansen et al., 1975) and 3.84 x 10-11 cm3/molecule?sec (Atkinson, 1985). At 25 °C, a rate constant of 3.15 x 10-11 cm3/molecule?sec was reported for the same reaction (Ohta and Ohyama, 1985). Products identified from the OH radical-initiated reaction of 1,2,4-trimethylbenzene in the presence of nitrogen dioxide were 3-hexene-2,5-dione and 2,3-butanedione (Bethel et al., 2000).
Chemical/Physical. 1,2,4-Trimethylbenzene will not hydrolyze in water (Kollig, 1993).

Purification Methods

Reflux pseudocumene over sodium and distil it under reduced pressure. [Beilstein 6 H 1088, 6 I 542, 6 II 1072, 6 III 6278, 6 IV 7339.]

1,2,4-Trimethylbenzene Preparation Products And Raw materials

Raw materials

Preparation Products


1,2,4-Trimethylbenzene Suppliers

Global( 210)Suppliers
Supplier Tel Fax Email Country ProdList Advantage
NINGBO INNO PHARMCHEM CO., LTD.
13867897135
sales@nbinno.com CHINA 925 58
Xiamen AmoyChem Co., Ltd
+86 592-605 1114
sales@amoychem.com CHINA 6369 58
Xi'an Kono chem co., Ltd.,
13289246953 029-86107037
info@konochemical.com CHINA 3000 58
Hubei xin bonus chemical co. LTD
86-13657291602
027-59338440 linda@hubeijusheng.com CHINA 23035 58
HENAN BON INDUSTRIAL CO.,LTD
0371-55170695
info@hnbon.com CHINA 26742 58
career henan chemical co
13203830695 0086-371-86658258
0086-371-86658258 factory@coreychem.com CHINA 29865 58
Zhuozhou Wenxi import and Export Co., Ltd
+8613111626072 (WhatsApp)
Wechat: +8613111626072 Wickr me: waynehu zzwenxi@126.com CHINA 13187 58
Fuxin Pharmaceutical
021-50872116
contact@fuxinpharm.com CHINA 9519 58
Antai Fine Chemical Technology Co.,Limited
18503026267
info@antaichem.com CHINA 9664 58
Zhengzhou Alfa Chemical Co.,Ltd
+86 13343822234
sales5@alfachem.cn;sales9@alfachem.cn;sale1@alfachem.cn;sales7@alfachem.cn CHINA 15027 58

Related articles


View Lastest Price from 1,2,4-Trimethylbenzene manufacturers

Image Release date Product Price Min. Order Purity Supply Ability Manufacturer
2021-08-12 1,2,4-Trimethylbenzene
95-63-6
US $15.00-10.00 / KG 1KG 99%+ HPLC Monthly supply of 1 ton Zhuozhou Wenxi import and Export Co., Ltd
2021-07-29 1,2,4-trimethylbenzene
95-63-6
US $5.00 / KG 100g 99 20tons Wuhan wingroup Pharmaceutical Co., Ltd
2021-07-29 1,2,4-trimethylbenzene
95-63-6
US $1.00 / KG 100g 99 30tons Wuhan wingroup Pharmaceutical Co., Ltd

1,2,4-Trimethylbenzene Spectrum


95-63-6(1,2,4-Trimethylbenzene)Related Search:


Copyright 2017 © ChemicalBook. All rights reserved