N-Allylaniline
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MedKoo CAT#: 591811

CAS#: 589-09-3

Description: N-Allylaniline is used as a seperation material.


Chemical Structure

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N-Allylaniline
CAS# 589-09-3

Theoretical Analysis

MedKoo Cat#: 591811
Name: N-Allylaniline
CAS#: 589-09-3
Chemical Formula: C9H11N
Exact Mass: 133.0891
Molecular Weight: 133.194
Elemental Analysis: C, 81.16; H, 8.32; N, 10.52

Price and Availability

Size Price Availability Quantity
5.0g USD 260.0 2 Weeks
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Synonym: N-Allylaniline; AI3-10028; AI3 10028; AI310028

IUPAC/Chemical Name: Benzenamine, N-2-propenyl-

InChi Key: LQFLWKPCQITJIH-UHFFFAOYSA-N

InChi Code: InChI=1S/C9H11N/c1-2-8-10-9-6-4-3-5-7-9/h2-7,10H,1,8H2

SMILES Code: C=CCNC1=CC=CC=C1

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: >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: 2934.99.03.00

Product Data:

Biological target: N-Allylaniline is used as a seperation material.
In vitro activity: TBD
In vivo activity: TBD

Preparing Stock Solutions

The following data is based on the product molecular weight 133.194 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
Formulation protocol: TBD
In vitro protocol: TBD
In vivo protocol: TBD

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1: Dana M, Luliński P, Maciejewska D. Synthesis of homoveratric acid-imprinted polymers and their evaluation as selective separation materials. Molecules. 2011 May 5;16(5):3826-44. doi: 10.3390/molecules16053826. PubMed PMID: 21546882.

2: Mossine VV, Barnes CL, Mawhinney TP. Disordered hydrogen bonding in N-(1-deoxy-beta-D-fructopyranos-1-yl)-N-allylaniline. Carbohydr Res. 2009 May 12;344(7):948-51. doi: 10.1016/j.carres.2009.02.017. Epub 2009 Feb 25. PubMed PMID: 19345935.

3: Leroi C, Bertin D, Dufils PE, Gigmes D, Marque S, Tordo P, Couturier JL, Guerret O, Ciufolini MA. Alkoxyamine-mediated radical synthesis of indolinones and indolines. Org Lett. 2003 Dec 25;5(26):4943-5. PubMed PMID: 14682735.

4: Inoue S, Takamatsu N, Kishi Y. [Synthetic studies on echinulin and realted natural products. I. Acid-catalyzed amino-Claisen rearrangement of N-allylaniline and N,N-diallylaniline derivatives (author's transl)]. Yakugaku Zasshi. 1977 May;97(5):553-7. Japanese. PubMed PMID: 560461.