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1,3-Bis(trifluoromethyl)benzene, 98+%

Catalog No. aaa1136018
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1000 g
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50 g
Catalog No. Quantity
AAA1136018 50 g
AAA1136030 250 g
AAA113600B 1000 g
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Catalog No. AAA1136018

Supplier: Thermo Scientific Chemicals A1136018

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CAS: 402-31-3 | C8H4F6 | 214.11 g/mol

1,3-Bis(trifluoromethyl)benzene undergoes regioselective metalation and subsequent carboxylation at position 2 to give 2,6-bis(trifluoromethyl)benzoic acid. a convenient, selective synthesis of bis[2,4-bis(trifluoromethyl)phenyl]phosphane derivatives with 1,3-bis(trifluoromethyl)benzene as starting material.

This Thermo Scientific Chemicals brand product was originally part of the Alfa Aesar product portfolio. Some documentation and label information may refer to the legacy brand. The original Alfa Aesar product / item code or SKU reference has not changed as a part of the brand transition to Thermo Scientific Chemicals.

Applications
1,3-Bis(trifluoromethyl)benzene undergoes regioselective metalation and subsequent carboxylation at position 2 to give 2,6-bis(trifluoromethyl)benzoic acid. a convenient, selective synthesis of bis[2,4-bis(trifluoromethyl)phenyl]phosphane derivatives with 1,3-bis(trifluoromethyl)benzene as starting material.

Solubility
Insoluble in water. Soluble in alcohol, ether, benzene.

Notes
Store in cool place. Keep container tightly closed in a dry and well-ventilated place. Store away from strong oxidizing agents.

Chemical Identifiers

CAS 402-31-3
Molecular Formula C8H4F6
Molecular Weight (g/mol) 214.11
MDL Number MFCD00000392
InChI Key SJBBXFLOLUTGCW-UHFFFAOYSA-N
Synonym 1,3-bis trifluoromethyl benzene, benzene, 1,3-bis trifluoromethyl, 1,3-di trifluoromethyl benzene, 1,3-bis trifluoromethyl-benzene, m-bis trifluoromethyl benzene, m-ditrifluoromethylbenzene, hexafluoro-m-xylene, alpha,alpha,alpha,alpha',alpha',alpha'-hexafluoro-m-xylene, mtf-tfm, a,a,a,a',a',a'-hexafluoro-m-xylene
PubChem CID 223106
IUPAC Name 1,3-bis(trifluoromethyl)benzene
SMILES C1=CC(=CC(=C1)C(F)(F)F)C(F)(F)F

Specifications

Melting Point -35°C
Density 1.378
Boiling Point 115°C to 117°C
Flash Point 26°C (78°F)
Odor Aromatic
Refractive Index 1.379
Quantity 50 g
UN Number UN1993
Beilstein 2052589
Solubility Information Insoluble in water. Soluble in alcohol,ether,benzene.
Formula Weight 214.11
Percent Purity ≥98%
Chemical Name or Material 1,3-Bis (trifluoromethyl)benzene
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Hazard Category H226-H315-H319-H335
Hazard Statement GHS H Statement
H226-H315-H319-H335
Flammable liquid and vapor.
Causes skin irritation.
Causes serious eye irritation.
May cause respiratory irritation.
Precautionary Statement P210-P233-P235-P240-P241-P242-P243-P261-P264b-P271-P280-P303+P361+P353-P304+P340-P305+P351+P338-P312-P332+P313-P363-P370+P378q-P501c
DOTInformation Transport Hazard Class: 3; Packing Group: III; Proper Shipping Name: FLAMMABLE LIQUIDS, N.O.S.
EINECSNumber 206-939-4
TSCA Yes
Recommended Storage Ambient temperatures

RUO – Research Use Only