Diethyl fumarate, 98%, Thermo Scientific Chemicals

Product Code	Brand	Quantity	Packaging
10773641	Thermo Scientific Acros 114380100	10 g	Glass Bottle
10697062	Thermo Scientific Acros 114382500	250 g	Glass bottle
10687062	Thermo Scientific Acros 114380010	1 kg	Glass bottle
13448308	Thermo Scientific Acros 114380025	2.5 kg	Glass bottle

Description

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

Chemical Identifiers

• CAS: 623-91-6
• Molecular Weight (g/mol): 172.18
• InChI Key: IEPRKVQEAMIZSS-AATRIKPKSA-N
• PubChem CID: 638144
• IUPAC Name: diethyl (E)-but-2-enedioate

• Molecular Formula: C8H12O4
• MDL Number: MFCD00064455
• Synonym: diethyl fumarate, fumaric acid, diethyl ester, anti-psoriaticum, diethyl 2e-but-2-enedioate, fumaric acid diethyl ester, diethyl e-but-2-enedioate, 2-butenedioic acid e-, diethyl ester, trans-2-butenedioic acid diethyl ester, 2-butenedioic acid 2e-, diethyl ester, unii-5wbu5a3e8a
• ChEBI: CHEBI:87388
• SMILES: CCOC(=O)\C=C\C(=O)OCC

Specifications

• CAS: 623-91-6
• Color: Colorless to Yellow
• Boiling Point: 218.0°C to 219.0°C
• Infrared Spectrum: Authentic
• Molecular Formula: C8H12O4
• Refractive Index: 1.4396 to 1.4416
• Specific Gravity: 1.05
• Solubility Information: Solubility in water: immiscible.
• SMILES: CCOC(=O)\C=C\C(=O)OCC
• Molecular Weight (g/mol): 172.18
• ChEBI: CHEBI:87388
• Percent Purity: 98%
• Chemical Name or Material: Diethyl fumarate, 98%

• Melting Point: 1.0°C to 2.0°C
• Density: 1.0500g/mL
• Flash Point: 91°C
• Assay Percent Range: 98%
• Linear Formula: C₂H₅O₂CCH=CHCO₂C₂H₅
• MDL Number: MFCD00064455
• Synonym: diethyl fumarate, fumaric acid, diethyl ester, anti-psoriaticum, diethyl 2e-but-2-enedioate, fumaric acid diethyl ester, diethyl e-but-2-enedioate, 2-butenedioic acid e-, diethyl ester, trans-2-butenedioic acid diethyl ester, 2-butenedioic acid 2e-, diethyl ester, unii-5wbu5a3e8a
• InChI Key: IEPRKVQEAMIZSS-AATRIKPKSA-N
• IUPAC Name: diethyl (E)-but-2-enedioate
• PubChem CID: 638144
• Formula Weight: 172.18
• Physical Form: Liquid

Safety and Handling

GHS H Statement:
Harmful if swallowed.

GHS P Statement:
IF SWALLOWED: Call a POISON CENTER or doctor/physician if you feel unwell.

WARNING: The information provided on this web site was developed in compliance with European Union (EU) regulations and is correct to the best of our knowledge, information and belief at the date of its publication. The information given is designed only as a guide for safe handling and use. It is not to be considered as either a warranty or quality specification.

missing translation for 'einecsNumber' : 210-819-7

missing translation for 'rtecsNumber' : EM5950000

missing translation for 'tsca' : TSCA

RUO – Research Use Only