1,3-Di-tert-butylbenzene
1,3-Di-tert-butylbenzene (CAS: 1014-60-4), with the molecular formula C14H22 and a molar mass of 190.32 g/mol, is a sterically hindered aromatic hydrocarbon. Its structure, featuring two bulky tert-butyl groups meta to each other on a benzene ring, influences its reactivity and physical properties. This compound primarily serves as a building block in organic synthesis and chemical research, contributing to the construction of more complex molecular architectures.
- Synonyms
- C6H4[C(CH3)3]2
![1,3-Di-tert-butylbenzene (C6H4[C(CH3)3]2) — chemical structure, CAS 1014-60-4; Chemistry, fine chemical supplied by Tech Serve Solutions](/_next/image?url=https%3A%2F%2Fpub-f4d920c906024441a773a96f7098e551.r2.dev%2Fimages%2Fproducts%2F1014-60-4.png&w=3840&q=75)
Organic Synthesis Intermediate
1,3-Di-tert-butylbenzene is utilised as a precursor or intermediate in the synthesis of various organic compounds. Its bulky tert-butyl groups can direct regioselectivity in reactions or impart specific steric properties to target molecules.
Research and Development
In R&D settings, this compound finds application as a versatile building block for creating novel materials and molecules. Its unique steric hindrance makes it valuable for studying reaction mechanisms or developing sterically demanding ligands.
Ligand Synthesis
The steric bulk of 1,3-Di-tert-butylbenzene can be advantageous in the synthesis of specialised ligands for catalysis. These ligands may offer unique coordination environments and influence the activity or selectivity of metal catalysts.
| Molecular weight | 190.32 |
|---|---|
| Linear formula | C6H4[C(CH3)3]2 |
| Assay | 97% |
| Boiling point | 106-107 °C/18 mmHg(lit.) |
| Density | 0.859 g/mL at 25 °C(lit.) |
| Refractive index | n20/D 1.488(lit.) |
| Melting point | 10-11 °C(lit.) |
| Protective equipment | Eyeshields, full-face respirator (US), Gloves, multi-purpose combination respirator cartridge (US), type ABEK (EN14387) respirator filter |
|---|---|
| Flash point | 84 °C / 183.2 °F |
| Transport (UN / ADR) | NA 1993 / PGIII |
| Water hazard class (WGK, DE) | 3 |
Hazard information is provided for guidance. Always consult the product Safety Data Sheet (SDS), available on request, before handling.
Documentation
Every batch ships with a Certificate of Analysis covering assay, identity and purity; the grade is confirmed against your enquiry. Safety Data Sheets and technical data sheets are available on request.
Supply & logistics
Samples for technical evaluation; bulk MOQ by grade and packaging. In-stock material ships in 7–10 working days, worldwide, with full export documentation.
What is 1,3-Di-tert-butylbenzene used for?
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1,3-Di-tert-butylbenzene is primarily used as a building block in organic synthesis and for research and development purposes, including the synthesis of specialised ligands.
What is the CAS number and chemical formula for 1,3-Di-tert-butylbenzene?
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The CAS number for 1,3-Di-tert-butylbenzene is 1014-60-4, and its linear formula is C6H4[C(CH3)3]2.
What grade and purity does Tech Serve Solutions supply?
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Tech Serve Solutions supplies 1,3-Di-tert-butylbenzene with an assay of 97%. We do not represent this product as meeting any pharmacopoeia standards such as USP, BP, or EP.
How should 1,3-Di-tert-butylbenzene be handled safely?
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Handling requires appropriate personal protective equipment, including eyeshields and suitable gloves. Respiratory protection, such as a multi-purpose combination respirator cartridge or an ABEK respirator filter, is recommended. It has a flash point of 84°C (183.2°F).
Is 1,3-Di-tert-butylbenzene a controlled substance?
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The provided data does not indicate that 1,3-Di-tert-butylbenzene is a controlled substance.
How is 1,3-Di-tert-butylbenzene packed and exported?
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1,3-Di-tert-butylbenzene is classified under NA 1993 / PGIII for transport. Tech Serve Solutions is a global supplier and exporter experienced in shipping chemicals worldwide, adhering to all relevant regulations.
How can I request a quote or sample for 1,3-Di-tert-butylbenzene?
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Please contact our sales team through the website or by phone to request a quote or to arrange for a sample of 1,3-Di-tert-butylbenzene.
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