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Sigma-Aldrich

1,2-Dichloroethane-d4

99 atom % D

Synonym(s):

Ethylene-d4 dichloride

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About This Item

Linear Formula:
ClCD2CD2Cl
CAS Number:
17060-07-0
Molecular Weight:
102.98
MDL number:
MFCD00037531
UNSPSC Code:
12142201
PubChem Substance ID:
24864675
NACRES:
NA.21

isotopic purity

99 atom % D

Quality Level

200

Assay

99% (CP)

form

liquid

technique(s)

NMR: suitable

refractive index

n20/D 1.443 (lit.)

bp

83 °C (lit.)

mp

−35 °C (lit.)

density

1.307 g/mL at 25 °C (lit.)

application(s)

agriculture
environmental

mass shift

M+4

SMILES string

[2H]C([2H])(Cl)C([2H])([2H])Cl

InChI

1S/C2H4Cl2/c3-1-2-4/h1-2H2/i1D2,2D2

InChI key

WSLDOOZREJYCGB-LNLMKGTHSA-N

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General description

1,2-Dichloroethane-d4 is 1,2-dichloroethane with all the hydrogen atoms replaced by deuterium. Its synthesis and structure elucidation by neutron diffraction measurements has been reported.

Application

1,2-Dichloroethane-d4 may be used:
  • As a NMR solvent.
  • As a surrogate standard during the analysis of volatile organic compounds (VOC) in water by gas chromatography-mass spectrometry (GC-MS).
  • As a chain termination reagent in the synthesis of poly(ethylene-d4 oxide).

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Signal Word

Danger

Hazard Classifications

Acute Tox. 3 Inhalation - Acute Tox. 4 Oral - Asp. Tox. 1 - Carc. 1B - Eye Irrit. 2 - Flam. Liq. 2 - Skin Irrit. 2 - STOT SE 3

Target Organs

Respiratory system

Storage Class Code

3 - Flammable liquids

WGK

WGK 3

Flash Point(F)

60.8 °F - closed cup - Based on data from similar materials

Flash Point(C)

16.0 °C - closed cup - Based on data from similar materials

Regulatory Listings

Regulatory Listings are mainly provided for chemical products. Only limited information can be provided here for non-chemical products. No entry means none of the components are listed. It is the user’s obligation to ensure the safe and legal use of the product.

EU REACH SVHC Candidate List

CAS No.

EU REACH Annex XVII (Restriction List)

CAS No.

EU REACH Annex XIV (Authorisation List)

CAS No.

Certificates of Analysis (COA)

Search for Certificates of Analysis (COA) by entering the products Lot/Batch Number. Lot and Batch Numbers can be found on a product’s label following the words ‘Lot’ or ‘Batch’.

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Solvent Effect on Chiral Aggregate Formation of Acylamino Acids.
Iwahashi M, et al.
Journal of Oleo Science, 51(11), 705-713 (2002)
An automated GC/MS system for the analysis of volatile and semi-volatile organic compounds in water.
Vickers AK and Wright LM.
Journal of Analytical Methods in Chemistry, 15(4), 133-139 (1993)
Volatile organic compounds in water near petrochemical factories in Taiwan.
Kuo HW, et al.
Chemosphere, 33(5), 913-920 (1996)
The structure of liquid 1, 2 dichloroethane by neutron diffraction. I. Molecular structure, full pair correlation function, and temperature effects.
Bermejo FJ, et al.
J. Chem. Phys. , 87(12), 7171-7178 (1987)
Synthesis of poly (ethylene-d4oxide) with unimodal and narrow molecular weight distribution.
Eisenbach CD, et al.
Macromolecular Chemistry and Physics, 184(11), 2313-2323 (1983)
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