Bromo[2-(ethoxycarbonyl-kappaO)phenyl-kappaC]zinc structure

Bromo[2-(ethoxycarbonyl-kappaO)phenyl-kappaC]zinc

TL;DR: Bromo[2-(ethoxycarbonyl-kappaO)phenyl-kappaC]zinc (CAS 131379-40-3) is a chemical compound with molecular formula C9H9BrO2Zn and molecular weight 291.91 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.

bromozinc(1+);ethyl benzoate

Also Known As: Parsalmide, bromozinc(1+);ethyl benzoate, 2- PHENYLZINCBROMIDE, 2-(ETHOXYCARBONYL)PHENYLZINC BROMIDE, 2-ETHOXYCARBONYLPHENYLZINC BROMIDE

CAS: 131379-40-3
Molecular Formula C9H9BrO2Zn
Molecular Weight 291.91 g/mol
LogP 2.50659
Topological Polar Surface Area 26.3 Ų
Hydrogen Bond Donors 0
Hydrogen Bond Acceptors 2
Rotatable Bonds 2
Exact Mass 291.9077
Heavy Atoms 13
Complexity 238.62984

Chemical Identifiers

CAS Number 131379-40-3
SMILES CCOC(=O)C1=CC=CC=[C-]1.[Zn+]Br

Product Overview

Bromo[2-(ethoxycarbonyl-kappaO)phenyl-kappaC]zinc (CAS 131379-40-3), with molecular formula C9H9BrO2Zn and molecular weight 291.91 g/mol. IUPAC: bromozinc(1+);ethyl benzoate.

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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 Bromo[2-(ethoxycarbonyl-kappaO)phenyl-kappaC]zinc

XLogP
2.50659
TPSA (Topological Polar Surface Area)
26.3
Hydrogen Bond Donors
0
Hydrogen Bond Acceptors
2
Rotatable Bonds
2
Heavy Atoms
13
Complexity
238.62984
Exact Mass
291.9077
Monoisotopic Mass
291.9077
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 Bromo[2-(ethoxycarbonyl-kappaO)phenyl-kappaC]zinc

The XLogP value of 2.50659 suggests moderate lipophilicity, balancing water solubility and membrane permeability for Bromo[2-(ethoxycarbonyl-kappaO)phenyl-kappaC]zinc. With a topological polar surface area (TPSA) of 26.3 Ų, Bromo[2-(ethoxycarbonyl-kappaO)phenyl-kappaC]zinc exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, Bromo[2-(ethoxycarbonyl-kappaO)phenyl-kappaC]zinc has 0 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 Bromo[2-(ethoxycarbonyl-kappaO)phenyl-kappaC]zinc?

The CAS number of Bromo[2-(ethoxycarbonyl-kappaO)phenyl-kappaC]zinc is 131379-40-3.

What is the molecular formula of Bromo[2-(ethoxycarbonyl-kappaO)phenyl-kappaC]zinc?

The molecular formula of Bromo[2-(ethoxycarbonyl-kappaO)phenyl-kappaC]zinc is C9H9BrO2Zn.

What is the molecular weight of Bromo[2-(ethoxycarbonyl-kappaO)phenyl-kappaC]zinc?

The molecular weight of Bromo[2-(ethoxycarbonyl-kappaO)phenyl-kappaC]zinc is 291.91 g/mol.

Where can I buy Bromo[2-(ethoxycarbonyl-kappaO)phenyl-kappaC]zinc?

You can request a quote for Bromo[2-(ethoxycarbonyl-kappaO)phenyl-kappaC]zinc directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.

Does KEHONG BIO offer custom synthesis for Bromo[2-(ethoxycarbonyl-kappaO)phenyl-kappaC]zinc?

Yes, KEHONG BIO provides custom synthesis services for Bromo[2-(ethoxycarbonyl-kappaO)phenyl-kappaC]zinc and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.

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