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485489

Sigma-Aldrich

Dichloroacetic acid-2-13C

99 atom % 13C

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About This Item

Linear Formula:
Cl213CHCO2H
CAS Number:
Molecular Weight:
129.93
MDL number:
UNSPSC Code:
12352200
PubChem Substance ID:

isotopic purity

99 atom % 13C

Quality Level

Assay

99% (CP)

bp

194 °C (lit.)

mp

9-11 °C (lit.)

density

1.575 g/mL at 25 °C

mass shift

M+1

SMILES string

OC(=O)[13CH](Cl)Cl

InChI

1S/C2H2Cl2O2/c3-1(4)2(5)6/h1H,(H,5,6)/i1+1

InChI key

JXTHNDFMNIQAHM-OUBTZVSYSA-N

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Shimin Wu et al.
Journal of chromatography. A, 1487, 100-107 (2017-01-26)
The addition of oxidants for disinfecting water can lead to the formation of potentially carcinogenic compounds referred to as disinfection byproducts (DBPs). Haloacetic acids (HAAs) are one of the most widely detected DBPs in US water utilities and some of

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