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Benzylamine, o-bromo-N-ethyl-N-(3-iodopropyl)-, oxalate structure
Fine Chemical

Benzylamine, o-bromo-N-ethyl-N-(3-iodopropyl)-, oxalate

TL;DR: Benzylamine, o-bromo-N-ethyl-N-(3-iodopropyl)-, oxalate (CAS 40616-81-7) is a chemical compound with molecular formula C14H19BrINO4 and molecular weight 470.95422 g/mol, supplied by CoreyChem (Career Henan Chemical Co., Ltd.) with ISO-certified quality and global shipping.

(2-bromophenyl)methyl-ethyl-(3-iodopropyl)azanium;2-hydroxy-2-oxoacetate

Also Known As: o-Bromo-N-ethyl-N-(3-iodopropyl)benzylamine oxalate, BENZYLAMINE, o-BROMO-N-ETHYL-N-(3-IODOPROPYL)-, OXALATE, N-(2-Bromobenzyl)-N-(3-iodopropyl)ethylamine oxalate, (2-bromophenyl)methyl-ethyl-(3-iodopropyl)azanium; 2-hydroxy-2-oxoacetate, N-[(2-Bromophenyl)methyl]-N-ethyl-3-iodopropan-1-aminium hydrogen ethanedioate

CAS Number
40616-81-7
Molecular Formula
C14H19BrINO4
Molecular Weight
470.95422 g/mol
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Technical Specifications

Molecular FormulaC14H19BrINO4
Molecular Weight470.95422 g/mol
XLogP0.5
Topological Polar Surface Area (TPSA)81.9 Ų
Hydrogen Bond Donors2
Hydrogen Bond Acceptors4
Rotatable Bonds6
Exact Mass470.95422 Da
Heavy Atoms21
Complexity244.0
SMILESCC[NH+](CCCI)CC1=CC=CC=C1Br.C(=O)(C(=O)[O-])O
InChIKeyAEUSXTQEDGWDIE-UHFFFAOYSA-N

Product Description

Applications: Benzylamine, o-bromo-N-ethyl-N-(3-iodopropyl)-, oxalate is used in organic synthesis and process chemistry. It commonly serves as a versatile building block for organic synthesis. CoreyChem supplies Benzylamine, o-bromo-N-ethyl-N-(3-iodopropyl)-, oxalate (CAS 40616-81-7) with custom synthesis available from milligram to multi-kilogram scale, supported by COA, MSDS, and HPLC/NMR/MS documentation.

Benzylamine, o-bromo-N-ethyl-N-(3-iodopropyl)-, oxalate is a fine chemical identified by CAS number 40616-81-7 and the molecular formula C14H19BrINO4 and a molecular weight of 470.95 g/mol. It is also known as o-Bromo-N-ethyl-N-(3-iodopropyl)benzylamine oxalate and BENZYLAMINE, o-BROMO-N-ETHYL-N-(3-IODOPROPYL)-, OXALATE.

Custom synthesis and full analytical documentation (COA/MSDS) are available from CoreyChem. Request a quotation with your required quantity and purity for current lead time and pricing.

Chemical Property Profile of Benzylamine, o-bromo-N-ethyl-N-(3-iodopropyl)-, oxalate

XLogP
0.5
TPSA (Topological Polar Surface Area)
81.9
Hydrogen Bond Donors
2
Hydrogen Bond Acceptors
4
Rotatable Bonds
6
Heavy Atoms
21
Complexity
244.0
Exact Mass
470.95422
Monoisotopic Mass
470.95422
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 Benzylamine, o-bromo-N-ethyl-N-(3-iodopropyl)-, oxalate

The XLogP value of 0.5 suggests moderate lipophilicity, balancing water solubility and membrane permeability for Benzylamine, o-bromo-N-ethyl-N-(3-iodopropyl)-, oxalate. The TPSA of 81.9 Ų falls within the moderate polarity range, balancing permeability and solubility for Benzylamine, o-bromo-N-ethyl-N-(3-iodopropyl)-, oxalate. Following Lipinski's Rule of Five, Benzylamine, o-bromo-N-ethyl-N-(3-iodopropyl)-, oxalate has 2 hydrogen bond donor(s) and 4 hydrogen bond acceptor(s), all within the drug-like range, suggesting favorable oral bioavailability potential.

Frequently Asked Questions

What is the CAS number of Benzylamine, o-bromo-N-ethyl-N-(3-iodopropyl)-, oxalate?

The CAS number of Benzylamine, o-bromo-N-ethyl-N-(3-iodopropyl)-, oxalate is 40616-81-7.

What is the molecular formula of Benzylamine, o-bromo-N-ethyl-N-(3-iodopropyl)-, oxalate?

The molecular formula of Benzylamine, o-bromo-N-ethyl-N-(3-iodopropyl)-, oxalate is C14H19BrINO4.

What is the molecular weight of Benzylamine, o-bromo-N-ethyl-N-(3-iodopropyl)-, oxalate?

The molecular weight of Benzylamine, o-bromo-N-ethyl-N-(3-iodopropyl)-, oxalate is 470.95422 g/mol.

What are the applications of Benzylamine, o-bromo-N-ethyl-N-(3-iodopropyl)-, oxalate?

Benzylamine, o-bromo-N-ethyl-N-(3-iodopropyl)-, oxalate is used in organic synthesis and process chemistry. It commonly serves as a versatile building block for organic synthesis. CoreyChem supplies Benzylamine, o-bromo-N-ethyl-N-(3-iodopropyl)-, oxalate (CAS 40616-81-7) with custom synthesis...

Where can I buy Benzylamine, o-bromo-N-ethyl-N-(3-iodopropyl)-, oxalate?

You can request a quote for Benzylamine, o-bromo-N-ethyl-N-(3-iodopropyl)-, oxalate directly from CoreyChem. Contact us or email [email protected] for pricing and availability.

Does CoreyChem offer custom synthesis for Benzylamine, o-bromo-N-ethyl-N-(3-iodopropyl)-, oxalate?

Yes, CoreyChem provides custom synthesis services for Benzylamine, o-bromo-N-ethyl-N-(3-iodopropyl)-, oxalate and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.

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