MedKoo Cat#: 596351 | Name: Fluazolate

Description:

WARNING: This product is for research use only, not for human or veterinary use.

Fluazolate is a herbicide for pre-emergence control of broad-leaved weeds and grasses.

Chemical Structure

Fluazolate
Fluazolate
CAS#174514-07-9

Theoretical Analysis

MedKoo Cat#: 596351

Name: Fluazolate

CAS#: 174514-07-9

Chemical Formula: C15H12BrClF4N2O2

Exact Mass: 441.9707

Molecular Weight: 443.62

Elemental Analysis: C, 40.61; H, 2.73; Br, 18.01; Cl, 7.99; F, 17.13; N, 6.31; O, 7.21

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Synonym
Fluazolate; Isopropazol; MON 48500; MON-48500; MON48500; JV-485; JV485; JV 485;
IUPAC/Chemical Name
isopropyl 5-(4-bromo-1-methyl-5-(trifluoromethyl)-1H-pyrazol-3-yl)-2-chloro-4-fluorobenzoate
InChi Key
FKLQIONHGSFYJY-UHFFFAOYSA-N
InChi Code
InChI=1S/C15H12BrClF4N2O2/c1-6(2)25-14(24)7-4-8(10(18)5-9(7)17)12-11(16)13(15(19,20)21)23(3)22-12/h4-6H,1-3H3
SMILES Code
O=C(OC(C)C)C1=CC(C2=NN(C)C(C(F)(F)F)=C2Br)=C(F)C=C1Cl
Appearance
Solid powder
Purity
>98% (or refer to the Certificate of Analysis)
Shipping Condition
Shipped under ambient temperature as non-hazardous chemical. This product is stable enough for a few weeks during ordinary shipping and time spent in Customs.
Storage Condition
Dry, dark and at 0 - 4 C for short term (days to weeks) or -20 C for long term (months to years).
Solubility
Soluble in DMSO
Shelf Life
>2 years if stored properly
Drug Formulation
This drug may be formulated in DMSO
Stock Solution Storage
0 - 4 C for short term (days to weeks), or -20 C for long term (months).
HS Tariff Code
2934.99.9001
More Info

Preparing Stock Solutions

The following data is based on the product molecular weight 443.62 Batch specific molecular weights may vary from batch to batch due to the degree of hydration, which will affect the solvent volumes required to prepare stock solutions.

Recalculate based on batch purity %
Concentration / Solvent Volume / Mass 1 mg 5 mg 10 mg
1 mM 1.15 mL 5.76 mL 11.51 mL
5 mM 0.23 mL 1.15 mL 2.3 mL
10 mM 0.12 mL 0.58 mL 1.15 mL
50 mM 0.02 mL 0.12 mL 0.23 mL
1: Foster RS, Jakobi H, Harrity JP. A general and regioselective synthesis of 5-trifluoromethyl-pyrazoles. Org Lett. 2012 Sep 21;14(18):4858-61. Epub 2012 Aug 30. PubMed PMID: 22934538.