吡啶啶基

Description

Pyridalyl · CAS 179101-81-6 · C18H14Cl4F3NO3. UNII QTD92Z2P2Z. Boiling Point: 227 °C (decomposes); Solubility: In water, 150 mg/L at 20 °C; Density: 1.44 at 20 °C.

Identification

CAS Registry Number	179101-81-6
PubChem CID	11488729
Molecular formula	C18H14Cl4F3NO3
IUPAC name	2-[3-[2,6-dichloro-4-(3,3-dichloroprop-2-enoxy)phenoxy]propoxy]-5-(trifluoromethyl)pyridine
UNII (FDA)	QTD92Z2P2Z

Computed Descriptors

Molecular Weight	491.1
XLogP3	7.1
Hydrogen Bond Donor Count	0
Hydrogen Bond Acceptor Count	7
Rotatable Bond Count	9
Exact Mass	490.965038
Monoisotopic Mass	488.967989
Topological Polar Surface Area	40.6
Heavy Atom Count	29
Formal Charge	0

Physical & Chemical Properties

Boiling Point	227 °C (decomposes)
Solubility	In water, 150 mg/L at 20 °C
Density	1.44 at 20 °C
Vapor Pressure	6.24X10-5 mPa /SRC: 4.68X10-10 mm Hg/ at 20 °C

Physical description & handling notes

• Liquid
• In acetone, acetonitrile, chloroform, DMF, ethyl acetate, hexanes, n-octanol and xylenes >1000 g/L; in methanol >500 g/L
• 203.0 Ų [M+H]+ [CCS Type: DT; Buffer gas: N2; Ionization: APCI+; Dataset: TOXCAST; Source Identifier: DTXSID8034875]
• 215.0 Ų [M+Na]+ [CCS Type: DT; Buffer gas: N2; Ionization: ESI+; Dataset: TOXCAST; Source Identifier: DTXSID8034875]
• 203.8 Ų [M+H]+ [CCS Type: DT; Buffer gas: N2; Ionization: ESI+; Dataset: TOXCAST; Source Identifier: DTXSID8034875]
• Overture 35 WP Insecticide (Valent U.S.A. Corporation) 34-36% Pyridalyl

GHS Hazard Classification

Reported hazard statements	H317, H400, H410

Documented Uses

• For control of thrips and caterpillars in ornamentals.
• Groups of 3 Sprague-Dawley (Crl:CDBR) rats/sex/group were dosed with pyridalyl of high purity, to which labeled pyridalyl (either phenyl or propenyl-labeled) pyridalyl of at least 97% purity was added to achieve 5 or 500 mg/kg single gavage doses at 50 uCi/rat. The study evaluated radioactivity in many tissues sampled at 4 times (based on results of Record No. 242040): 1/2 Cmax (absorption), Cmax, 1/2 Cmax (elimination), and 1/10 Cmax (elimination). These sampling times were 4, 8, 24, and 48 hrs for 5 mg/kg phenyl

Synonyms

pyridalyl; 179101-81-6; OVERTURE; QTD92Z2P2Z; TESORO; S-1812; NOCTURN; PLEO; DTXSID8034875; S 1812; s1812; CHEBI:38887; 2-(3-{2,6-dichloro-4-[(3,3-dichloroprop-2-en-1-yl)oxy]phenoxy}propoxy)-5-(trifluoromethyl)pyridine; Pyridine, 2-(3-(2,6-dichloro-4-((3,3-dichloro-2-propen-1-yl)oxy)phenoxy)propoxy)-5-(trifluoromethyl)-; Pyridine, 2-(3-(2,6-dichloro-4-((3,3-dichloro-2-propenyl)oxy)phenoxy)propoxy)-5-(trifluoromethyl)-; 2-(3-(2,6-Dichloro-4-((3,3-dichloro-2-propen-1-yl)oxy)phenoxy)propoxy)-5-(trifluoromethyl)pyridine

Frequently Asked Questions

What are the CAS number and molecular formula of Pyridalyl?

CAS 179101-81-6; molecular formula C18H14Cl4F3NO3; molecular weight — g/mol.

What other names is Pyridalyl known by?

pyridalyl, 179101-81-6, OVERTURE, QTD92Z2P2Z, TESORO, S-1812.

Is Pyridalyl classified as hazardous?

Hazard statements reported: H317, H400, H410.

What are the key physical properties of Pyridalyl?

Boiling Point: 227 °C (decomposes); Solubility: In water, 150 mg/L at 20 °C; Density: 1.44 at 20 °C; Vapor Pressure: 6.24X10-5 mPa /SRC: 4.68X10-10 mm Hg/ at 20 °C.

Facts on this page are taken from PubChem (US National Library of Medicine) and Wikidata. Grade-specific data — assay, moisture, particle size, packaging, shelf life — is issued per batch on the COA and is not published here.