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(E)-but-2-enedioic acid;3-prop-2-ynoxy-1-azabicyclo[2.2.2]octane structure
Fine Chemical

(E)-but-2-enedioic acid;3-prop-2-ynoxy-1-azabicyclo[2.2.2]octane

TL;DR: (E)-but-2-enedioic acid;3-prop-2-ynoxy-1-azabicyclo[2.2.2]octane (CAS 147025-54-5) is a chemical compound with molecular formula C14H19NO5 and molecular weight 281.1263 g/mol, supplied by CoreyChem (Career Henan Chemical Co., Ltd.) with ISO-certified quality and global shipping.

(E)-but-2-enedioic acid;3-prop-2-ynoxy-1-azabicyclo[2.2.2]octane

Also Known As: Talsaclidine fumarate, (E)-but-2-enedioic acid, Wal 2014 FU, Talsaclidine fumarate (USAN), 3-prop-2-ynoxy-1-azabicyclo[2.2.2]octane

CAS Number
147025-54-5
Molecular Formula
C14H19NO5
Molecular Weight
281.1263 g/mol
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Technical Specifications

Molecular FormulaC14H19NO5
Molecular Weight281.1263 g/mol
XLogP0.4422
Topological Polar Surface Area (TPSA)87.1 Ų
Hydrogen Bond Donors2
Hydrogen Bond Acceptors6
Rotatable Bonds4
Exact Mass281.1263 Da
Heavy Atoms20
Complexity316.0
SMILESC#CCOC1CN2CCC1CC2.C(=C/C(=O)O)\C(=O)O
InChIKeySBCXBWBXWKVIFK-WLHGVMLRSA-N

Chemical Property Profile of (E)-but-2-enedioic acid;3-prop-2-ynoxy-1-azabicyclo[2.2.2]octane

XLogP
0.4422
TPSA (Topological Polar Surface Area)
87.1
Hydrogen Bond Donors
2
Hydrogen Bond Acceptors
6
Rotatable Bonds
4
Heavy Atoms
20
Complexity
316.0
Exact Mass
281.1263
Monoisotopic Mass
281.1263
Data Source: Chemical property values are referenced from PubChem, the world's largest open chemistry database maintained by the National Center for Biotechnology Information (NCBI), U.S. National Library of Medicine.

Property Insights of (E)-but-2-enedioic acid;3-prop-2-ynoxy-1-azabicyclo[2.2.2]octane

The XLogP value of 0.4422 suggests moderate lipophilicity, balancing water solubility and membrane permeability for (E)-but-2-enedioic acid;3-prop-2-ynoxy-1-azabicyclo[2.2.2]octane. The TPSA of 87.1 Ų falls within the moderate polarity range, balancing permeability and solubility for (E)-but-2-enedioic acid;3-prop-2-ynoxy-1-azabicyclo[2.2.2]octane. Following Lipinski's Rule of Five, (E)-but-2-enedioic acid;3-prop-2-ynoxy-1-azabicyclo[2.2.2]octane has 2 hydrogen bond donor(s) and 6 hydrogen bond acceptor(s), all within the drug-like range, suggesting favorable oral bioavailability potential.

Frequently Asked Questions

What is the CAS number of (E)-but-2-enedioic acid;3-prop-2-ynoxy-1-azabicyclo[2.2.2]octane?

The CAS number of (E)-but-2-enedioic acid;3-prop-2-ynoxy-1-azabicyclo[2.2.2]octane is 147025-54-5.

What is the molecular formula of (E)-but-2-enedioic acid;3-prop-2-ynoxy-1-azabicyclo[2.2.2]octane?

The molecular formula of (E)-but-2-enedioic acid;3-prop-2-ynoxy-1-azabicyclo[2.2.2]octane is C14H19NO5.

What is the molecular weight of (E)-but-2-enedioic acid;3-prop-2-ynoxy-1-azabicyclo[2.2.2]octane?

The molecular weight of (E)-but-2-enedioic acid;3-prop-2-ynoxy-1-azabicyclo[2.2.2]octane is 281.1263 g/mol.

Where can I buy (E)-but-2-enedioic acid;3-prop-2-ynoxy-1-azabicyclo[2.2.2]octane?

You can request a quote for (E)-but-2-enedioic acid;3-prop-2-ynoxy-1-azabicyclo[2.2.2]octane directly from CoreyChem. Contact us or email [email protected] for pricing and availability.

Does CoreyChem offer custom synthesis for (E)-but-2-enedioic acid;3-prop-2-ynoxy-1-azabicyclo[2.2.2]octane?

Yes, CoreyChem provides custom synthesis services for (E)-but-2-enedioic acid;3-prop-2-ynoxy-1-azabicyclo[2.2.2]octane and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.

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