MedKoo Cat#: 462003 | Name: 3-Quinuclidinyl xanthene-9-carboxylate

Description:

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

3-Quinuclidinyl xanthene-9-carboxylate is a Muscarinic receptor antagonist.

Chemical Structure

3-Quinuclidinyl xanthene-9-carboxylate
3-Quinuclidinyl xanthene-9-carboxylate
CAS#102585-08-0

Theoretical Analysis

MedKoo Cat#: 462003

Name: 3-Quinuclidinyl xanthene-9-carboxylate

CAS#: 102585-08-0

Chemical Formula: C21H21NO3

Exact Mass: 335.1521

Molecular Weight: 335.40

Elemental Analysis: C, 75.20; H, 6.31; N, 4.18; O, 14.31

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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Synonym
3-Quinuclidinyl xanthene-9-carboxylate; 3-Quinuclidyl xanthene-9-carboxylate; Xanthene-9-carboxylic acid, 3-quinuclidinyl ester
IUPAC/Chemical Name
quinuclidin-3-yl 1H-xanthene-9-carboxylate
InChi Key
VWFBHVWTXINIBX-UHFFFAOYSA-N
InChi Code
InChI=1S/C21H21NO3/c23-21(25-19-13-22-11-9-14(19)10-12-22)20-15-5-1-3-7-17(15)24-18-8-4-2-6-16(18)20/h1-5,7-8,14,19H,6,9-13H2
SMILES Code
O=C(OC1CN2CCC1CC2)C3=C4CC=CC=C4OC5=CC=CC=C53
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
2934.99.9001
More Info

Preparing Stock Solutions

The following data is based on the product molecular weight 335.40 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: Rat hippocampal muscarinic autoreceptors are similar to the M2 (cardiac) subtype: comparison with hippocampal M1, atrial M2 and ileal M3 receptors. M. H. Richards Br J Pharmacol. 1990 Apr; 99(4): 753–761. doi: 10.1111/j.1476-5381.1990.tb13002.x PMCID: PMC1917567 2: The Impact of Removal of Ovarian Hormones on Cholinergic Muscarinic Receptors: Examining Prepulse Inhibition and Receptor Binding Sarah S. Ch’ng, Adam J. Walker, Madeleine McCarthy, Thien-Kim Le, Natalie Thomas, Andrew Gibbons, Madhara Udawela, Snezana Kusljic, Brian Dean, Andrea Gogos Brain Sci. 2020 Feb; 10(2): 106. Published online 2020 Feb 17. doi: 10.3390/brainsci10020106 PMCID: PMC7071400 3: Conversion of Sterically Demanding α,α-Disubstituted Phenylacetonitriles by the Arylacetonitrilase from Pseudomonas fluorescens EBC191 Stefanie Baum, Dael S. Williamson, Trevor Sewell, Andreas Stolz Appl Environ Microbiol. 2012 Jan; 78(1): 48–57. doi: 10.1128/AEM.05570-11 PMCID: PMC3255610