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614661

Sigma-Aldrich

3-Chloro-1,2-propanediol-1,1,2,3,3-d5

98 atom % D, 97% (CP)

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About This Item

Linear Formula:
ClCD2CD(OH)CD2OH
Molecular Weight:
115.57
MDL number:
MFCD01317355
UNSPSC Code:
12352101
PubChem Substance ID:
329759499

isotopic purity

98 atom % D

Quality Level

200

assay

97% (CP)

bp

216-219 °C

density

1.381 g/mL at 25 °C

mass shift

M+5

SMILES string

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

InChI

1S/C3H7ClO2/c4-1-3(6)2-5/h3,5-6H,1-2H2/i1D2,2D2,3D

InChI key

SSZWWUDQMAHNAQ-UXXIZXEISA-N

Related Categories

Packaging

This product may be available from bulk stock and can be packaged on demand. For information on pricing, availability and packaging, please contact Stable Isotopes Customer Service.

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Danger

Hazard Classifications

Acute Tox. 2 Oral - Carc. 2 - Eye Dam. 1 - Muta. 2 - Repr. 1B

Storage Class

6.1A - Combustible acute toxic Cat. 1 and 2 / very toxic hazardous materials

wgk_germany

WGK 3

flash_point_f

Not applicable

flash_point_c

Not applicable

ppe

Eyeshields, Faceshields, Gloves, type ABEK (EN14387) respirator filter

Certificates of Analysis (COA)

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Thorsten Buhrke et al.
Archives of toxicology, 89(12), 2243-2251 (2014-10-31)
The food contaminants 3-chloro-1,2-propanediol (3-MCPD) and 3-MCPD fatty acid esters have attracted considerable attention in the past few years due to their toxic properties and their occurrence in numerous foods. Recently, significant amounts of the isomeric compounds 2-chloro-1,3-propanediol (2-MCPD) fatty
Roberta Andreoli et al.
Analytical and bioanalytical chemistry, 407(16), 4823-4827 (2015-04-12)
A new method for the simultaneous quantitative determination in human urine of 3-monochloropropane-1,2-diol (3-MCPD), a toxic food contaminant, and its metabolite, 2,3-dihydroxypropyl mercapturic acid (DHPMA), was developed and validated. After urine dilution, the analytes were separated on an Atlantis®dC18 column

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