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Meperfluthrin
915288-13-0 | DTXSID6058217

Searched by Approved Name: Found 1 result for 'Meperfluthrin'.

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Intrinsic Properties

Molecular Formula: C17H16Cl2F4O3

Average Mass: 415.21 g/mol

Monoisotopic Mass: 414.041262 g/mol

Structural Identifiers

IUPAC Name: [2,3,5,6-Tetrafluoro-4-(methoxymethyl)phenyl]methyl (1R,3S)-3-(2,2-dichloroethenyl)-2,2-dimethylcyclopropane-1-carboxylate

SMILES: COCC1=C(F)C(F)=C(COC(=O)[C@@H]2[C@@H](C=C(Cl)Cl)C2(C)C)C(F)=C1F

InChI String: InChI=1S/C17H16Cl2F4O3/c1-17(2)9(4-10(18)19)11(17)16(24)26-6-8-14(22)12(20)7(5-25-3)13(21)15(8)23/h4,9,11H,5-6H2,1-3H3/t9-,11+/m1/s1

InChIKey: MWFQAAWRPDRKDG-KOLCDFICSA-N

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Structural Skeleton Full Structure

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Citation

U.S. Environmental Protection Agency. Chemistry Dashboard. https://comptox.epa.gov/dashboard/DTXSID6058217 (accessed April 22, 2018), Meperfluthrin

Data Quality

Level 1:Expert curated, highest confidence in accuracy and consistency of unique chemical identifiers

Level 2:Expert curated, unique chemical identifiers using multiple sources

Level 3:Programmatically curated from high quality EPA source, unique chemical identifiers have no conflicts in ChemID and PubChem

Level 4:Programmatically curated from ChemID, unique chemical identifiers have no conflicts in PubChem

Level 5:Programmatically curated from ACToR or PubChem, unique chemical identifiers with low confidence, single public source

No Quality Control Notes.

Property

Average

Median

Range

Unit

Experimental

Predicted

Experimental

Predicted

Experimental

Predicted

LogP: Octanol-Water

-

5.43 (5)

-

5.49

-

5.02 to 5.95

-

Water Solubility

-

8.88e-07 (4)

-

5.61e-07

-

4.88e-08 to 2.38e-06

mol/L

Density

-

1.45 (2)

-

1.45

-

1.44 to 1.46

g/cm^3

Flash Point

-

157 (2)

-

157

-

113 to 200

°C

Melting Point

-

68.9 (4)

-

51.5

-

37.8 to 135

°C

Boiling Point

-

341 (5)

-

357

-

276 to 379

°C

Surface Tension

-

44.2 (1)

- - - -

dyn/cm

Thermal Conductivity

-

122 (1)

- - - -

mW/(m*K)

Vapor Pressure

-

2.94e-06 (4)

-

2.74e-06

-

2.97e-07 to 6.00e-06

mmHg

LogKoa: Octanol-Air

-

9.38 (1)

- - - - -

Henry's Law

-

5.79e-09 (1)

- - - -

atm-m3/mole

Index of Refraction

-

1.54 (1)

- - - - -

Molar Refractivity

-

90.5 (1)

- - - -

cm^3

Molar Volume

-

288 (1)

- - - -

cm^3

Polarizability

-

35.9 (1)

- - - -

Å^3

LogP: Octanol-Water

Average

Median

Range

Experimental - - -
Predicted

5.43 (5)

5.49

5.02 to 5.95

Predicted

Source

Result

Calculation Details

QMRF

EPISUITE

5.95

Not Available

Not Available

NICEATM

5.49

Not Available

Available

ACD/Labs Consensus

5.55

Not Available

Not Available

ACD/Labs

5.14

Not Available

Not Available

OPERA

5.02

OPERA Model Report

Available

Water Solubility

Average

Median

Range

Experimental - - -
Predicted

8.88e-07 (4)

5.61e-07

4.88e-08 to 2.38e-06

Predicted

Source

Result

Calculation Details

QMRF

EPISUITE

4.88e-08 mol/L

Not Available

Not Available

NICEATM

4.23e-07 mol/L

Not Available

Available

TEST

6.98e-07 mol/L

TEST Report

Not Available

OPERA

2.38e-06 mol/L

OPERA Model Report

Available

Density

Average

Median

Range

Experimental - - -
Predicted

1.45 (2)

1.45

1.44 to 1.46

Predicted

Source

Result

Calculation Details

QMRF

ACD/Labs

1.44 g/cm^3

Not Available

Not Available

TEST

1.46 g/cm^3

TEST Report

Not Available

Flash Point

Average

Median

Range

Experimental - - -
Predicted

157 (2)

157

113 to 200

Predicted

Source

Result

Calculation Details

QMRF

ACD/Labs

113 °C

Not Available

Not Available

TEST

200 °C

TEST Report

Not Available

Melting Point

Average

Median

Range

Experimental - - -
Predicted

68.9 (4)

51.5

37.8 to 135

Predicted

Source

Result

Calculation Details

QMRF

EPISUITE

135 °C

Not Available

Not Available

NICEATM

39.9 °C

Not Available

Available

TEST

37.8 °C

TEST Report

Not Available

OPERA

63.2 °C

OPERA Model Report

Available

Boiling Point

Average

Median

Range

Experimental - - -
Predicted

341 (5)

357

276 to 379

Predicted

Source

Result

Calculation Details

QMRF

EPISUITE

366 °C

Not Available

Not Available

NICEATM

276 °C

Not Available

Available

ACD/Labs

379 °C

Not Available

Not Available

TEST

357 °C

TEST Report

Not Available

OPERA

325 °C

OPERA Model Report

Available

Surface Tension

Average

Median

Range

Experimental - - -
Predicted

44.2 (1)

-

-
Predicted

Source

Result

Calculation Details

QMRF

ACD/Labs

44.2 dyn/cm

Not Available

Not Available

Thermal Conductivity

Average

Median

Range

Experimental - - -
Predicted

122 (1)

-

-
Predicted

Source

Result

Calculation Details

QMRF

TEST

122 mW/(m*K)

TEST Report

Not Available

Vapor Pressure

Average

Median

Range

Experimental - - -
Predicted

2.94e-06 (4)

2.74e-06

2.97e-07 to 6.00e-06

Predicted

Source

Result

Calculation Details

QMRF

NICEATM

2.97e-07 mmHg

Not Available

Available

ACD/Labs

6.00e-06 mmHg

Not Available

Not Available

TEST

6.03e-07 mmHg

TEST Report

Not Available

OPERA

4.87e-06 mmHg

OPERA Model Report

Available

LogKoa: Octanol-Air

Average

Median

Range

Experimental - - -
Predicted

9.38 (1)

-

-
Predicted

Source

Result

Calculation Details

QMRF

OPERA

9.38

OPERA Model Report

Available

Henry's Law

Average

Median

Range

Experimental - - -
Predicted

5.79e-09 (1)

-

-
Predicted

Source

Result

Calculation Details

QMRF

OPERA

5.79e-09 atm-m3/mole

OPERA Model Report

Available

Index of Refraction

Average

Median

Range

Experimental - - -
Predicted

1.54 (1)

-

-
Predicted

Source

Result

Calculation Details

QMRF

ACD/Labs

1.54

Not Available

Not Available

Molar Refractivity

Average

Median

Range

Experimental - - -
Predicted

90.5 (1)

-

-
Predicted

Source

Result

Calculation Details

QMRF

ACD/Labs

90.5 cm^3

Not Available

Not Available

Molar Volume

Average

Median

Range

Experimental - - -
Predicted

288 (1)

-

-
Predicted

Source

Result

Calculation Details

QMRF

ACD/Labs

288 cm^3

Not Available

Not Available

Polarizability

Average

Median

Range

Experimental - - -
Predicted

35.9 (1)

-

-
Predicted

Source

Result

Calculation Details

QMRF

ACD/Labs

35.9 Å^3

Not Available

Not Available

Property

Average

Median

Range

Unit

Experimental

Predicted

Experimental

Predicted

Experimental

Predicted

Soil Adsorp. Coeff.

-

1570 (1)

- - - -

L/kg

Atmos. Hydroxylation Rate

-

2.18e-11 (1)

- - - -

cm3/molecule*sec

Biodeg. Half-Life

-

3.35 (1)

- - - -

days

Fish Biotrans. Half-Life (Km)

-

5.05 (1)

- - - -

days

Bioconcentration Factor

-

769 (3)

-

467

-

27.1 to 1810

-

Soil Adsorp. Coeff.

Average

Median

Range

Experimental - - -
Predicted

1570 (1)

-

-
Predicted

Source

Result

Calculation Details

QMRF

OPERA

1570 L/kg

OPERA Model Report

Available

Atmos. Hydroxylation Rate

Average

Median

Range

Experimental - - -
Predicted

2.18e-11 (1)

-

-
Predicted

Source

Result

Calculation Details

QMRF

OPERA

2.18e-11 cm3/molecule*sec

OPERA Model Report

Available

Biodeg. Half-Life

Average

Median

Range

Experimental - - -
Predicted

3.35 (1)

-

-
Predicted

Source

Result

Calculation Details

QMRF

OPERA

3.35 days

OPERA Model Report

Available

Fish Biotrans. Half-Life (Km)

Average

Median

Range

Experimental - - -
Predicted

5.05 (1)

-

-
Predicted

Source

Result

Calculation Details

QMRF

OPERA

5.05 days

OPERA Model Report

Available

Bioconcentration Factor

Average

Median

Range

Experimental - - -
Predicted

769 (3)

467

27.1 to 1810

Predicted

Source

Result

Calculation Details

QMRF

NICEATM

27.1

Not Available

Available

TEST

467

TEST Report

Not Available

OPERA

1810

OPERA Model Report

Available

Found 6 synonyms

  • Legend:
  • Valid Synonyms
  • Good Synonyms
  • Other Synonyms
Meperfluthrin
[2,3,5,6-Tetrafluoro-4-(methoxymethyl)phenyl]methyl (1R,3S)-3-(2,2-dichloroethenyl)-2,2-dimethylcyclopropane-1-carboxylate
Cyclopropanecarboxylic acid, 3-(2,2-dichloroethenyl)-2,2-dimethyl-, [2,3,5,6-tetrafluoro-4-(methoxymethyl)phenyl]methyl ester, (1R,3S)-
915288-13-0 Active CAS-RN
Cyclopropanecarboxylic acid, 3-(2,2-dichloroethenyl)-2,2-dimethyl-, [2,3,5,6-tetrafluoro-4-(methoxymethyl)phenyl]methyl ester, (1R,3S)-
UNII-L4LQ8HV8XP FDA Registry Number
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National Health and Nutrition Examination Survey (NHANES) Inferences

There is no exposure monitoring data available.

Exposure Predictions

There is no exposure data available.

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Executive Summary

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