Synonym
AI3-62694, B 4576, BRN 2179006, Caswell No. 271BB, CGA 10832, EPA Pesticide Chemical Code 106601, Profluralin, ER5461, GA-10832, HSDB 3923, Pregard, Profluraline, SGA 10832, Tolban
IUPAC/Chemical Name
p-Toluidine, N-(cyclopropylmethyl)-2,6-dinitro-N-propyl-alpha,alpha,alpha-trifluoro-
InChi Key
ITVQAKZNYJEWKS-UHFFFAOYSA-N
InChi Code
1S/C14H16F3N3O4/c1-2-5-18(8-9-3-4-9)13-11(19(21)22)6-10(14(15,16)17)7-12(13)20(23)24/h6-7,9H,2-5,8H2,1H3
SMILES Code
c1(c(cc(C(F)(F)F)cc1[N+](=O)[O-])[N+](=O)[O-])N(CC1CC1)CCC
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
To be determined
Shelf Life
>3 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
Biological target:
Profluralin is an aromatic hydrocarbon based herbicide.
In vitro activity:
To be determined
In vivo activity:
To be determined
Preparing Stock Solutions
The following data is based on the
product
molecular weight
347.29
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.
| 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 |
Formulation protocol:
To be determined
In vitro protocol:
To be determined
In vivo protocol:
To be determined
1: Vassetti D, Pagliai M, Procacci P. Assessment of GAFF2 and OPLS-AA General Force Fields in Combination with the Water Models TIP3P, SPCE, and OPC3 for the Solvation Free Energy of Druglike Organic Molecules. J Chem Theory Comput. 2019 Mar 12;15(3):1983-1995. doi: 10.1021/acs.jctc.8b01039. Epub 2019 Feb 14. PMID: 30694667.
2: Arrowood MJ, Mead JR, Xie L, You X. In vitro anticryptosporidial activity of dinitroaniline herbicides. FEMS Microbiol Lett. 1996 Mar 1;136(3):245-9. doi: 10.1111/j.1574-6968.1996.tb08056.x. PMID: 8867379.
3: Schibler MJ, Huang B. The colR4 and colR15 beta-tubulin mutations in Chlamydomonas reinhardtii confer altered sensitivities to microtubule inhibitors and herbicides by enhancing microtubule stability. J Cell Biol. 1991 May;113(3):605-14. doi: 10.1083/jcb.113.3.605. PMID: 1673126; PMCID: PMC2288959.
4: Jacobson AR, Gerig JT. Metabolism of profluralin in rats. 1. Identification of metabolites. Chem Res Toxicol. 1988 Sep-Oct;1(5):304-11. doi: 10.1021/tx00005a008. PMID: 2979747.
5: Edgerton TR, Scott W, Linder RE. Methodology for the determination of dinitroaniline herbicides in tissue and excreta. J Anal Toxicol. 1985 Jan- Feb;9(1):15-9. doi: 10.1093/jat/9.1.15. PMID: 3981970.
6: Jacobson SN, O'mara NL, Alexander M. Evidence for cometabolism in sewage. Appl Environ Microbiol. 1980 Nov;40(5):917-21. doi: 10.1128/aem.40.5.917-921.1980. PMID: 16345657; PMCID: PMC291690.
7: Honeycutt RC, Adler IR, Boka G, Secrest WL, Simoneaux BJ, Sumner DD. Incorporation of foreign compound metabolites into plant and soil constituents. J Environ Pathol Toxicol. 1980 Jun-Jul;3(5-6):21-33. PMID: 7441081.
8: Camper ND, Stralka K, Skipper HD. Aerobic and anaerobic degradation of profluralin and trifluralin. J Environ Sci Health B. 1980;15(5):457-73. doi: 10.1080/03601238009372196. PMID: 7430552.
9: Smith AE. Use of acetonitrile for the extraction of herbicide residues from soils. J Chromatogr. 1976 Dec 22;129:309-14. doi: 10.1016/s0021-9673(00)87789-4. PMID: 12188.
