tert-Butylbenzene
- CAS No.
- 98-06-6
- Chemical Name:
- tert-Butylbenzene
- Synonyms
- T-BUTYLBENZENE;Phenyltrim;-Trimethyltoluene;tert-butyl-benzen;tert.-Butylbenzol;TERT-BUTYLBENZENE;AKOS BBS-00004358;PSEUDOBUTYLBENZENE;Reaxys ID: 4964438;tert-Butylbenzeneb
- CBNumber:
- CB6161293
- Molecular Formula:
- C10H14
- Molecular Weight:
- 134.22
- MDL Number:
- MFCD00008816
- MOL File:
- 98-06-6.mol
- MSDS File:
- SDS
- TDS File:
- TDS
| Product description | Number | Pack Size | Price |
| tert-Butylbenzene 99% | B90602 | 1l | $146 |
| tert-Butylbenzene >98.0%(GC) | B0715 | 25mL | $26 |
| tert-Butylbenzene >98.0%(GC) | B0715 | 500mL | $61 |
| tert-Butylbenzene 99% | B90602 | 5ml | $47.8 |
| tert-Butylbenzene 99% | B90602 | 250ml | $49.9 |
| More product size | |||
| Melting point | -58 °C |
|---|---|
| Boiling point | 169 °C(lit.) |
| Density | 0.867 g/mL at 25 °C(lit.) |
| vapor density | 3.16 (169 °C, vs air) |
| vapor pressure | 4.79 mm Hg ( 37.7 °C) |
| refractive index |
n |
| Flash point | 94 °F |
| storage temp. | Flammables area |
| solubility | 29.5mg/l |
| form | Liquid |
| pka | >14 (Schwarzenbach et al., 1993) |
| color | Clear colorless to yellow |
| explosive limit | 0.8-5.6%(V) |
| Water Solubility | 0.03 g/L (20 ºC) |
| Thermal Conductivity | 0.117 W/(m·K) at 25 ℃ |
| Merck | 14,1551 |
| BRN | 1421537 |
| Henry's Law Constant | (x 10-2 atmm3/mol): 1.17 at 25 °C (Hine and Mookerjee, 1975) |
| Dielectric constant | 2.4（20℃） |
| Stability | Stable. Flammable. Incompatible with oxidizing agents, combustible material. |
| InChI | 1S/C10H14/c1-10(2,3)9-7-5-4-6-8-9/h4-8H,1-3H3 |
| InChIKey | YTZKOQUCBOVLHL-UHFFFAOYSA-N |
| SMILES | CC(C)(C)c1ccccc1 |
| CAS DataBase Reference | 98-06-6(CAS DataBase Reference) |
| FDA UNII | M1R2NME7S2 |
| NIST Chemistry Reference | Benzene, tert-butyl-(98-06-6) |
| EPA Substance Registry System | tert-Butylbenzene (98-06-6) |
| UNSPSC Code | 12352100 |
| NACRES | NA.22 |
SAFETY
Risk and Safety Statements
| Symbol(GHS) |   GHS02,GHS07 |
|||||||||
|---|---|---|---|---|---|---|---|---|---|---|
| Signal word | Warning | |||||||||
| Hazard statements | H226-H315 | |||||||||
| Precautionary statements | P210-P233-P240-P241-P242-P303+P361+P353 | |||||||||
| PPE | Eyeshields, Faceshields, Gloves, type ABEK (EN14387) respirator filter | |||||||||
| Hazard Codes | Xn,F,Xi,N | |||||||||
| Risk Statements | 10-20-38-51/53-36 | |||||||||
| Safety Statements | 23-24/25-61-26 | |||||||||
| RIDADR | UN 2709 3/PG 3 | |||||||||
| WGK Germany | 1 | |||||||||
| RTECS | CY9120000 | |||||||||
| Autoignition Temperature | 842 °F | |||||||||
| Hazard Note | Irritant/Flammable | |||||||||
| TSCA | TSCA listed | |||||||||
| HazardClass | 3 | |||||||||
| PackingGroup | III | |||||||||
| HS Code | 29029080 | |||||||||
| Storage Class | 3 - Flammable liquids | |||||||||
| Hazard Classifications | Flam. Liq. 3 Skin Irrit. 2 |
|||||||||
| Hazardous Substances Data | 98-06-6(Hazardous Substances Data) | |||||||||
| Limited Quantities | 5.0 L (1.3 gallons) (liquid) | |||||||||
| Excepted Quantities | Max Inner Pack (30g or 30ml) and Max Outer Pack (1Kg or 1L) | |||||||||
| NFPA 704 |
|
tert-Butylbenzene price More Price(22)
| Manufacturer | Product number | Product description | CAS number | Packaging | Price | Updated | Buy |
|---|---|---|---|---|---|---|---|
| Sigma-Aldrich | B90602 | tert-Butylbenzene 99% | 98-06-6 | 1l | $146 | 2026-04-30 | Buy |
| TCI Chemical | B0715 | tert-Butylbenzene >98.0%(GC) | 98-06-6 | 25mL | $26 | 2026-04-30 | Buy |
| TCI Chemical | B0715 | tert-Butylbenzene >98.0%(GC) | 98-06-6 | 500mL | $61 | 2026-04-30 | Buy |
| Sigma-Aldrich | B90602 | tert-Butylbenzene 99% | 98-06-6 | 5ml | $47.8 | 2026-04-30 | Buy |
| Sigma-Aldrich | B90602 | tert-Butylbenzene 99% | 98-06-6 | 250ml | $49.9 | 2026-04-30 | Buy |
tert-Butylbenzene Chemical Properties,Uses,Production
Chemical Properties
colourless liquid with an aromatic odour
Uses
tert-Butylbenzene is an useful intermediate for manufacturing agrochemicals and pharmaceuticals. tert-Butyl Toluene is used as a solvent for resins.
Uses
Organic synthesis, polymerization solvent, polymer linking agent.
Synthesis Reference(s)
The Journal of Organic Chemistry, 33, p. 923, 1968 DOI: 10.1021/jo01266a122
Tetrahedron Letters, 25, p. 4851, 1984 DOI: 10.1016/S0040-4039(01)91241-9
Hazard
Toxic by ingestion.
Safety Profile
Mildly toxic by ingestion. Flammable liquid when exposed to heat or flame. To fight fire, use foam, CO2, dry chemical, water spray, fog, mist. Incompatible with oxidizing materials. When heated to decomposition it emits acrid smoke and fumes
Environmental Fate
Photolytic. At 25 °C, a rate constant of 4.58 x 10-12 cm3/moleculesec was reported for the gasphase
reaction of tert-butylbenzene with OH radicals (Ohta and Ohyama, 1985).
Chemical/Physical. tert-Butylbenzene will not hydrolyze because it has no hydrolyzable
functional group (Kollig, 1995).
Purification Methods
Wash it with cold conc H2SO4 until a fresh portion of acid is no longer coloured, then with 10% aqueous NaOH (care-effervescence), followed by distilled water until neutral. Dry it (CaSO4), and distil it in a glass helices-packed column, taking the middle fraction. [Beilstein 5 IV 1045.]
Toxics Screening Level
The initial threshold screening level (ITSL) for t-Butyl benzene is 10 μg/m3 based on an annual averaging time.
tert-Butylbenzene Preparation Products And Raw materials
Raw materials
1of2
Preparation Products
1of3
| Supplier | Tel | Country | ProdList | Advantage | |
|---|---|---|---|---|---|
| Hebei Chuanghai Biotechnology Co., Ltd | +8615350571055 | Sibel@chuanghaibio.com | China | 8738 | 58 |
| Hebei Yanxi Chemical Co., Ltd. | +8618531123677 | faithe@yan-xi.com | China | 5853 | 58 |
| career henan chemical co | +86-0371-86658258 +8613203830695 | sales@coreychem.com | China | 29819 | 58 |
| CONIER CHEM AND PHARMA LIMITED | +8618523575427 | sales@conier.com | China | 49977 | 58 |
| Shaanxi Dideu Medichem Co. Ltd | +8617392709771 | 1097@dideu.com | China | 3996 | 58 |
| Richest Group Ltd | 18017061086 | oled@richest-group.com | CHINA | 5600 | 58 |
| Fuxin Pharmaceutical | +86-021-021-50872116 +8613122107989 | contact@fuxinpharm.com | China | 10000 | 58 |
| Neostar United (Changzhou) Industrial Co., Ltd. | +86-0519-85551759 +8613506123987 | marketing1@neostarunited.com | China | 8828 | 58 |
| SIMAGCHEM CORP | +86-5922680277 +86-13806087780 | sale@simagchem.com | China | 17346 | 58 |
| Jinan Qinmu Fine Chemical Co.,Ltd. | +8618660799346 | sales@qinmuchem.com | China | 1008 | 58 |
View Lastest Price from tert-Butylbenzene manufacturers
| Image | Update time | Product | Price | Min. Order | Purity | Supply Ability | Manufacturer | |
|---|---|---|---|---|---|---|---|---|
 |
2026-03-20 | tert-Butylbenzene
98-06-6
|
US $10.00 / KG | 1KG | 99% | 10 mt | Hebei Chuanghai Biotechnology Co., Ltd | |
 |
2025-12-24 | tert-Butylbenzene
98-06-6
|
US $0.10 / KG | 1KG | 99.0% | 1000 tons | Shaanxi Dideu Medichem Co. Ltd | |
 |
2025-06-20 | tert-Butylbenzeneb
98-06-6
|
US $0.00 / kg | 1kg | 0.99 | 20 tons | Hebei Yanxi Chemical Co., Ltd. |
-
- tert-Butylbenzene
98-06-6
- US $10.00 / KG
- 99%
- Hebei Chuanghai Biotechnology Co., Ltd
-
- tert-Butylbenzene
98-06-6
- US $0.10 / KG
- 99.0%
- Shaanxi Dideu Medichem Co. Ltd
-
- tert-Butylbenzeneb
98-06-6
- US $0.00 / kg
- 0.99
- Hebei Yanxi Chemical Co., Ltd.
