MedKoo Cat#: 145845 | Name: Piperonylonitrile

Description:

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

Piperonylonitrile is a chemical compound derived from piperonal, known for its potential applications in both synthetic chemistry and pharmacology. It has been studied for its ability to act as a precursor in the synthesis of various bioactive molecules and pharmaceutical intermediates. The mechanism of piperonylonitrile is believed to involve the modification of cellular signaling pathways, potentially affecting enzymes or receptors involved in inflammatory or neurological conditions. Due to its unique structure, piperonylonitrile has potential applications in developing new therapeutic agents, particularly for pain management and inflammatory diseases.

Chemical Structure

Piperonylonitrile
Piperonylonitrile
CAS#4421-09-4

Theoretical Analysis

MedKoo Cat#: 145845

Name: Piperonylonitrile

CAS#: 4421-09-4

Chemical Formula: C8H5NO2

Exact Mass: 147.0300

Molecular Weight: 147.13

Elemental Analysis: C, 65.31; H, 3.43; N, 9.52; O, 21.75

Price and Availability

This product is currently not in stock but may be available through custom synthesis. To ensure cost efficiency, the minimum order quantity is 1 gram. The estimated lead time is 2 to 4 months, with pricing dependent on the complexity of the synthesis (typically high for intricate chemistries). Quotes for quantities below 1 gram will not be provided. To request a quote, please click the button below. Note: If this product becomes available in stock in the future, pricing will be listed accordingly.
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Related CAS #
No Data
Synonym
Piperonylonitrile; AI3-31574; AI331574; AI3 31574; NSC-27009; NSC 27009; NSC27009;
IUPAC/Chemical Name
benzo[d][1,3]dioxole-5-carbonitrile
InChi Key
PKRWWZCDLJSJIF-UHFFFAOYSA-N
InChi Code
1S/C8H5NO2/c9-4-6-1-2-7-8(3-6)11-5-10-7/h1-3H,5H2
SMILES Code
N#CC1=CC2=C(OCO2)C=C1
Appearance
To be determined
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
>2 years if stored properly
Drug Formulation
To be determined
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 147.13 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: Nicolodi C, Slominski WH, Parabocz GC, Pericolo S, Da-Col JA, Martendal E. Headspace solid-phase microextraction - gas chromatography - mass spectrometry qualitative screening method for active compounds, adulterants and impurities in ecstasy tablets seized in Northern Santa Catarina State, Brazil. Forensic Sci Int. 2024 Feb;355:111932. doi: 10.1016/j.forsciint.2024.111932. Epub 2024 Jan 17. PMID: 38246066.