1-Pyrrolidinepropanol, beta,beta-dimethyl-alpha,alpha-diphenyl-, hydrobromide structure

1-Pyrrolidinepropanol, beta,beta-dimethyl-alpha,alpha-diphenyl-, hydrobromide

TL;DR: 1-Pyrrolidinepropanol, beta,beta-dimethyl-alpha,alpha-diphenyl-, hydrobromide (CAS 40598-52-5) is a chemical compound with molecular formula C21H28BrNO and molecular weight 389.14 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.

2,2-dimethyl-1,1-diphenyl-3-pyrrolidin-1-ylpropan-1-ol;hydrobromide

Also Known As: hexadecafluoro-oct-3-ene, 1,1-Diphenyl-2,2-dimethyl-3-(pyrrolidinyl)propanol hydrobromide, 1-Pyrrolidinepropanol, beta,beta-dimethyl-alpha,alpha-diphenyl-, hydrobromide, 2,2-dimethyl-1,1-diphenyl-3-(pyrrolidin-1-yl)propan-1-ol hydrobromide(1:1), alpha-(1,1-Dimethyl-2-(pyrrolidinyl)ethyl)benzhydrol hydrobromide

CAS: 40598-52-5
Molecular Formula C21H28BrNO
Molecular Weight 389.14 g/mol
LogP 4.6224
Topological Polar Surface Area 23.5 Ų
Hydrogen Bond Donors 2
Hydrogen Bond Acceptors 2
Rotatable Bonds 5
Exact Mass 389.13544
Heavy Atoms 24
Complexity 342.0

Chemical Identifiers

CAS Number 40598-52-5
SMILES CC(C)(CN1CCCC1)C(C2=CC=CC=C2)(C3=CC=CC=C3)O.Br
InChIKey HTXSRLCWXHPTRW-UHFFFAOYSA-N

Product Overview

1-Pyrrolidinepropanol, beta,beta-dimethyl-alpha,alpha-diphenyl-, hydrobromide (CAS 40598-52-5), with molecular formula C21H28BrNO and molecular weight 389.14 g/mol. IUPAC: 2,2-dimethyl-1,1-diphenyl-3-pyrrolidin-1-ylpropan-1-ol;hydrobromide.

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Safety Data Sheet (MSDS / SDS) View the Laboratory Chemical Safety Summary (LCSS) on PubChem — includes GHS classifications, hazard statements, first aid measures, and handling precautions.
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Chemical Property Profile of 1-Pyrrolidinepropanol, beta,beta-dimethyl-alpha,alpha-diphenyl-, hydrobromide

XLogP
4.6224
TPSA (Topological Polar Surface Area)
23.5
Hydrogen Bond Donors
2
Hydrogen Bond Acceptors
2
Rotatable Bonds
5
Heavy Atoms
24
Complexity
342.0
Exact Mass
389.13544
Monoisotopic Mass
389.13544
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 1-Pyrrolidinepropanol, beta,beta-dimethyl-alpha,alpha-diphenyl-, hydrobromide

The XLogP value of 4.6224 indicates that 1-Pyrrolidinepropanol, beta,beta-dimethyl-alpha,alpha-diphenyl-, hydrobromide is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. With a topological polar surface area (TPSA) of 23.5 Ų, 1-Pyrrolidinepropanol, beta,beta-dimethyl-alpha,alpha-diphenyl-, hydrobromide exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, 1-Pyrrolidinepropanol, beta,beta-dimethyl-alpha,alpha-diphenyl-, hydrobromide has 2 hydrogen bond donor(s) and 2 hydrogen bond acceptor(s), all within the drug-like range, suggesting favorable oral bioavailability potential.

Frequently Asked Questions

What is the typical lead time for this product?
Lead time typically ranges from 3-7 business days for in-stock items. For larger quantities or custom orders, please contact us for specific lead times.
Can you provide samples for testing?
Yes, we offer sample quantities for quality testing. Please submit an inquiry with your requirements and we will arrange samples accordingly.
What documentation do you provide with the product?
We provide COA (Certificate of Analysis), MSDS (Material Safety Data Sheet), and technical data sheets with each shipment.
Do you ship internationally?
Yes, we ship to most countries worldwide. Shipping costs and delivery times vary by location. Please contact us for specific shipping information.

Frequently Asked Questions

What is the CAS number of 1-Pyrrolidinepropanol, beta,beta-dimethyl-alpha,alpha-diphenyl-, hydrobromide?

The CAS number of 1-Pyrrolidinepropanol, beta,beta-dimethyl-alpha,alpha-diphenyl-, hydrobromide is 40598-52-5.

What is the molecular formula of 1-Pyrrolidinepropanol, beta,beta-dimethyl-alpha,alpha-diphenyl-, hydrobromide?

The molecular formula of 1-Pyrrolidinepropanol, beta,beta-dimethyl-alpha,alpha-diphenyl-, hydrobromide is C21H28BrNO.

What is the molecular weight of 1-Pyrrolidinepropanol, beta,beta-dimethyl-alpha,alpha-diphenyl-, hydrobromide?

The molecular weight of 1-Pyrrolidinepropanol, beta,beta-dimethyl-alpha,alpha-diphenyl-, hydrobromide is 389.14 g/mol.

Where can I buy 1-Pyrrolidinepropanol, beta,beta-dimethyl-alpha,alpha-diphenyl-, hydrobromide?

You can request a quote for 1-Pyrrolidinepropanol, beta,beta-dimethyl-alpha,alpha-diphenyl-, hydrobromide directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.

Does KEHONG BIO offer custom synthesis for 1-Pyrrolidinepropanol, beta,beta-dimethyl-alpha,alpha-diphenyl-, hydrobromide?

Yes, KEHONG BIO provides custom synthesis services for 1-Pyrrolidinepropanol, beta,beta-dimethyl-alpha,alpha-diphenyl-, hydrobromide and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.

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