1-Pyrrolidinepropanol, alpha,alpha-diphenyl-beta-methyl-, benzoate, oxalate
TL;DR: 1-Pyrrolidinepropanol, alpha,alpha-diphenyl-beta-methyl-, benzoate, oxalate (CAS 4071-26-5) is a chemical compound with molecular formula C29H31NO6 and molecular weight 489.22 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
(2-methyl-1,1-diphenyl-3-pyrrolidin-1-ylpropyl) benzoate;oxalic acid
Also Known As: 1-Benzoyloxy-1,1-diphenyl-2-methyl-3-pyrrolidylpropane oxalate, 1-Pyrrolidinepropanol, alpha,alpha-diphenyl-beta-methyl-, benzoate, oxalate, alpha,alpha-Diphenyl-beta-methyl-1-pyrrolidinepropanol benzoate oxalate, (2-methyl-1,1-diphenyl-3-pyrrolidin-1-ylpropyl) benzoate; oxalic acid, Oxalic acid--2-methyl-1,1-diphenyl-3-(pyrrolidin-1-yl)propyl benzoate (1/1)
| Molecular Formula | C29H31NO6 |
|---|---|
| Molecular Weight | 489.22 g/mol |
| LogP | 4.6747 |
| Topological Polar Surface Area | 104.0 Ų |
| Hydrogen Bond Donors | 2 |
| Hydrogen Bond Acceptors | 7 |
| Rotatable Bonds | 9 |
| Exact Mass | 489.21515 |
| Heavy Atoms | 36 |
| Complexity | 577.0 |
Chemical Identifiers
| CAS Number | 4071-26-5 |
|---|---|
| SMILES | CC(CN1CCCC1)C(C2=CC=CC=C2)(C3=CC=CC=C3)OC(=O)C4=CC=CC=C4.C(=O)(C(=O)O)O |
| InChIKey | LAZQOTSTOLFOAO-UHFFFAOYSA-N |
Product Overview
1-Pyrrolidinepropanol, alpha,alpha-diphenyl-beta-methyl-, benzoate, oxalate (CAS 4071-26-5), with molecular formula C29H31NO6 and molecular weight 489.22 g/mol. IUPAC: (2-methyl-1,1-diphenyl-3-pyrrolidin-1-ylpropyl) benzoate;oxalic acid.
Chemical Property Profile of 1-Pyrrolidinepropanol, alpha,alpha-diphenyl-beta-methyl-, benzoate, oxalate
Property Insights of 1-Pyrrolidinepropanol, alpha,alpha-diphenyl-beta-methyl-, benzoate, oxalate
The XLogP value of 4.6747 indicates that 1-Pyrrolidinepropanol, alpha,alpha-diphenyl-beta-methyl-, benzoate, oxalate is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. The TPSA of 104.0 Ų falls within the moderate polarity range, balancing permeability and solubility for 1-Pyrrolidinepropanol, alpha,alpha-diphenyl-beta-methyl-, benzoate, oxalate. Following Lipinski's Rule of Five, 1-Pyrrolidinepropanol, alpha,alpha-diphenyl-beta-methyl-, benzoate, oxalate has 2 hydrogen bond donor(s) and 7 hydrogen bond acceptor(s), all within the drug-like range, suggesting favorable oral bioavailability potential.
Frequently Asked Questions
Frequently Asked Questions
What is the CAS number of 1-Pyrrolidinepropanol, alpha,alpha-diphenyl-beta-methyl-, benzoate, oxalate?
The CAS number of 1-Pyrrolidinepropanol, alpha,alpha-diphenyl-beta-methyl-, benzoate, oxalate is 4071-26-5.
What is the molecular formula of 1-Pyrrolidinepropanol, alpha,alpha-diphenyl-beta-methyl-, benzoate, oxalate?
The molecular formula of 1-Pyrrolidinepropanol, alpha,alpha-diphenyl-beta-methyl-, benzoate, oxalate is C29H31NO6.
What is the molecular weight of 1-Pyrrolidinepropanol, alpha,alpha-diphenyl-beta-methyl-, benzoate, oxalate?
The molecular weight of 1-Pyrrolidinepropanol, alpha,alpha-diphenyl-beta-methyl-, benzoate, oxalate is 489.22 g/mol.
Where can I buy 1-Pyrrolidinepropanol, alpha,alpha-diphenyl-beta-methyl-, benzoate, oxalate?
You can request a quote for 1-Pyrrolidinepropanol, alpha,alpha-diphenyl-beta-methyl-, benzoate, oxalate directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 1-Pyrrolidinepropanol, alpha,alpha-diphenyl-beta-methyl-, benzoate, oxalate?
Yes, KEHONG BIO provides custom synthesis services for 1-Pyrrolidinepropanol, alpha,alpha-diphenyl-beta-methyl-, benzoate, oxalate and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.