CAS 93952-00-2|1,1,2-trichloro(1,2-13C2)ethene|1,1,2-trichloro(1,2-13C2)ethene|三氯乙烯-13C2|TCE-13C2|Trichloroethene-13C2|三氯乙烯-...

InChI=1S/C2HCl3/c3-1-2(4)5/h1H/i1+1,2+1

XSTXAVWGXDQKEL-ZDOIIHCHSA-N

Cl[13CH]=[13C](Cl)Cl

[13CH](=[13C](Cl)Cl)Cl

H Acceptors

H Donor

LogD (pH = 5.5)

2.1783347

LogD (pH = 7.4)

2.1783347

Log P

2.1783347

Molar Refractivity

35.177

Polarizability

9.912591

Polar Surface Area

0.0

Rotatable Bonds

Lipinski's Rule of Five

true

1,1,2-trichloro(1,2-¹³C₂)ethene

IUPAC Traditional name

1,1,2-trichloro(1,2-¹³C₂)ethene

三氯乙烯-13C2TCE-13C2Trichloroethene-13C2三氯乙烯-13C2Trichloroethylene-13C2

Mol. Weight

mol wt 133.35 by atom % calculation

Purity

97% (CP)

Linear Formula

ClH13C=13CCl2

Isotopic Purity

99 atom % 13C

M+2

86.7 °C(lit.)

1.485 g/mL at 25 °C

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719277

Packaging
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Data Source

Commercial Catalog

Academic Data

Names and Identifiers

IUPAC name

1,1,2-trichloro(1,2-¹³C₂)ethene

IUPAC Traditional name

1,1,2-trichloro(1,2-¹³C₂)ethene

Synonyms

三氯乙烯-13C2TCE-13C2Trichloroethene-13C2三氯乙烯-13C2Trichloroethylene-13C2

Registration numbers

MDL Number

CAS Number

PubChem SID

PubChem CID

Molecule Details

719277

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.

References

PubChem Literature

No Data Available

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Bioactivity

PubChem BioAssay

Respiratory sensitization, category 1

Germ cell mutagenicity, categories 1A,1B,2

Carcinogenicity, categories 1A,1B,2

Reproductive toxicity, categories 1A,1B,2

Specific Target Organ Toxicity – Single exposure, categories 1,2

Specific Target Organ Toxicity – Repeated exposure, categories 1,2

Aspiration Hazard, category 1

European Hazard Symbols

GHS Hazard statements

German water hazard class

GHS Precautionary statements

Molecule

ID:136255