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Molecule

Bifenthrin

CAS: 82657-04-3 · C23H22ClF3O2

2D Structure

3D Structure

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Basic Information

CAS Registry Number
82657-04-3
Molecular Formula
C23H22ClF3O2
Molecular Mass
422.87 g/mol

Identifiers

CAS Registry Number

82657-04-3

SMILES

Cc1c(COC(=O)[C@@H]2[C@H](/C=C(Cl)C(F)(F)F)C2(C)C)cccc1-c1ccccc1

InChI Key

OMFRMAHOUUJSGP-KLUXTTGUNA-N

InChI

InChI=1/C23H22ClF3O2/c1-14-16(10-7-11-17(14)15-8-5-4-6-9-15)13-29-21(28)20-18(22(20,2)3)12-19(24)23(25,26)27/h4-12,18,20H,13H2,1-3H3/b19-12-/t18-,20-/s2

Names and Synonyms

  • Bifenthrin Synonym
  • Talstar EZ Synonym
  • Cyclopropanecarboxylic acid, 3-[(1Z)-2-chloro-3,3,3-trifluoro-1-propen-1-yl]-2,2-dimethyl-, (2-methyl[1,1′-biphenyl]-3-yl)methyl ester, (1R,3R)-rel- Synonym
  • Cyclopropanecarboxylic acid, 3-(2-chloro-3,3,3-trifluoro-1-propenyl)-2,2-dimethyl-, (2-methyl[1,1′-biphenyl]-3-yl)methyl ester, [1α,3α(Z)]-(±)- Synonym
  • Cyclopropanecarboxylic acid, 3-[(1Z)-2-chloro-3,3,3-trifluoro-1-propenyl]-2,2-dimethyl-, (2-methyl[1,1′-biphenyl]-3-yl)methyl ester, (1R,3R)-rel- Synonym
  • FMC 54800 Synonym
  • Biphenthrin Synonym
  • Bifenthrin Synonym
  • Biphentrin Synonym
  • Talstar Synonym
  • Brigade Synonym
  • Capture Synonym
  • Capture (pesticide) Synonym
  • Biflex FT Synonym
  • Biflex Synonym
  • Brigade 10WP Synonym
  • Cyclopropanecarboxylic acid, 3-(2-chloro-3,3,3-trifluoro-1-propenyl)-2,2-dimethyl-, (2-methyl[1,1′-biphenyl]-3-yl)methyl ester, [1α,3α(Z)]- Synonym
  • Brigata Flo Synonym
  • Bifenthrine Synonym
  • Biphenate Synonym
  • TalstarOne Synonym
  • Semafor Synonym
  • Kiros EV Synonym
  • Empower Synonym
  • Discipline Synonym
  • Onyx Synonym
  • Onyx (insecticide) Synonym
  • Silencer Synonym
  • Fanfare Synonym
  • AGST 02002 Synonym
  • Capture LFR Synonym
  • Seizer Synonym
  • Bixan MG Synonym
  • DeterMite Synonym
  • Bifenture Synonym
  • Bixan Synonym
  • Sniper (pyrethroid insecticide) Synonym
  • (±)-Bifenthrin Synonym
  • rac-Bifenthrin Synonym
  • Talstar F Synonym
  • Gold insecticide Synonym
  • UP Star gold insecticide Synonym
  • UP Star Gold insecticide Synonym
  • Akate Master Synonym
  • Sniper Synonym
  • Talstar Pro Synonym
  • Gyro Synonym
  • Capture 2EC Synonym

All Properties

Comprehensive physical and chemical properties

Property Value Source
Molecular Mass 422.87 g/mol CAS Common Chemistry
422.8740000000001 g/mol RDKit
422.874 g/mol RDKit
422.871 g/mol chempirical lib
Density 1.21 g/cm³ CAS Common Chemistry
1.212 g/cm3 @ 25 °C CAS Common Chemistry
Wikipedia Url https://en.wikipedia.org/wiki/Bifenthrin CAS Common Chemistry
Canonical SMILES O=C(OCC1=CC=CC(C=2C=CC=CC2)=C1C)C3C(C=C(Cl)C(F)(F)F)C3(C)C CAS Common Chemistry
InChI InChI=1/C23H22ClF3O2/c1-14-16(10-7-11-17(14)15-8-5-4-6-9-15)13-29-21(28)20-18(22(20,2)3)12-19(24)23(25,26)27/h4-12,18,20H,13H2,1-3H3/b19-12-/t18-,20-/s2 CAS Common Chemistry
InChI Key InChIKey=OMFRMAHOUUJSGP-KLUXTTGUNA-N CAS Common Chemistry
Melting Point 69 °C CAS Common Chemistry
Name Bifenthrin CAS Common Chemistry
Heavy Atom Count 29 RDKit
Hydrogen Bond Acceptors 2 RDKit
Hydrogen Bond Donors 0 RDKit
Rotatable Bonds 5 RDKit
Aromatic Ring Count 2 RDKit
Topological Polar Surface Area 26.3 Ų RDKit
LogP 6.662420000000005 RDKit
6.6624 RDKit
6.53 chempirical lib
Molar Refractivity 107.16300000000001 cm³/mol RDKit
Ring Count 3 RDKit
Formal Charge 0 RDKit
Fraction Csp3 0.3478 RDKit
0.35 chempirical lib
Exact Mass 422.126042284 g/mol RDKit

Spectral Data

NMR, IR, and Mass spectral data

Predicting NMR spectra...
10 ppm 9 8 7 6 5 4 3 2 1 0 ppm
Shift (ppm) Multiplicity Integration Assignment

Note: These NMR spectra are predicted computationally and may differ from experimental data. Predictions are based on chemical environment analysis.

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MW = 422.87 g/mol; density = 1.210 g/mL. Edit any field — others recompute live.

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