2-Ethyltoluene, 98+%, Thermo Scientific Chemicals

Description

2-Ethyltoluene, is used to predict novel lead compounds for drug discovery that depends on the quality of the docking scoring function.

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
2-Ethyltoluene, is used to predict novel lead compounds for drug discovery that depends on the quality of the docking scoring function.

Solubility
Soluble in water (74.6 mg/L (25°C)).

Notes
Store away from strong oxidizing agents. Keep container tightly closed. Store in cool, dry conditions in well sealed containers.

Specifications

Chemical Identifiers

• CAS: 611-14-3
• Molecular Formula: C9H12
• Molecular Weight (g/mol): 120.195
• MDL Number: MFCD00009257
• InChI Key: HYFLWBNQFMXCPA-UHFFFAOYSA-N
• Synonym: 2-ethyltoluene, o-ethyltoluene, o-methylethylbenzene, 1-methyl-2-ethylbenzene, toluene, o-ethyl, ortho-ethyltoluene, benzene, 1-ethyl-2-methyl, 1,2-methylethylbenzene, o-ethyl methylbenzene, o-ethyl methyl benzene
• PubChem CID: 11903
• ChEBI: CHEBI:34276
• IUPAC Name: 1-ethyl-2-methylbenzene
• SMILES: CCC1=CC=CC=C1C

• Melting Point: -17°C
• Density: 0.884
• Boiling Point: 164°C to 165°C
• Flash Point: 53°C (127°F)
• Refractive Index: 1.504
• Quantity: 5 g
• UN Number: UN3295
• Beilstein: 1851237
• Solubility Information: Soluble in water (74.6mg/L (25°C)).
• Formula Weight: 120.2
• Percent Purity: ≥98%
• Chemical Name or Material: 2-Ethyltoluene

Safety and Handling

Hazard Category	H226-H304
Hazard Statement	GHS H Statement H304-H226 May be fatal if swallowed and enters airways. Flammable liquid and vapor.
Precautionary Statement	P210-P233-P240-P241-P242-P243-P280-P301+P310-P303+P361+P353-P331-P370+P378q-P501c
DOTInformation	Hazard Class: 3; Packaging Group: II
EINECSNumber	210-255-1
RTECSNumber	XT2500000
TSCA	Yes
Recommended Storage	Ambient temperatures

SDS

RUO – Research Use Only