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1,6-Bis(beta-phenylethylamino)hexane dihydrobromide structure
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1,6-Bis(beta-phenylethylamino)hexane dihydrobromide

TL;DR: 1,6-Bis(beta-phenylethylamino)hexane dihydrobromide (CAS 1049691-58-8) is a chemical compound with molecular formula C22H34Br2N2 and molecular weight 484.10886 g/mol, supplied by CoreyChem (Career Henan Chemical Co., Ltd.) with ISO-certified quality and global shipping.

N,N'-bis(2-phenylethyl)hexane-1,6-diamine;dihydrobromide

Also Known As: NIOSH/MO1345000, N,N'-Diphenethyl-1,6-hexanediamine dihydrobromide, N,N'-diphenethylhexane-1,6-diamine dihydrobromide, 1,6-Bis(beta-phenylethylamino)hexane dihydrobromide, 1,6-Hexanediamine, N,N'-diphenethyl-, dihydrobromide

CAS Number
1049691-58-8
Molecular Formula
C22H34Br2N2
Molecular Weight
484.10886 g/mol
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Technical Specifications

Molecular FormulaC22H34Br2N2
Molecular Weight484.10886 g/mol
XLogP5.3672
Topological Polar Surface Area (TPSA)24.1 Ų
Hydrogen Bond Donors4
Hydrogen Bond Acceptors2
Rotatable Bonds13
Exact Mass484.10886 Da
Heavy Atoms26
Complexity239.0
SMILESC1=CC=C(C=C1)CCNCCCCCCNCCC2=CC=CC=C2.Br.Br
InChIKeyNUYNFRBBCPKKOA-UHFFFAOYSA-N

Chemical Property Profile of 1,6-Bis(beta-phenylethylamino)hexane dihydrobromide

XLogP
5.3672
TPSA (Topological Polar Surface Area)
24.1
Hydrogen Bond Donors
4
Hydrogen Bond Acceptors
2
Rotatable Bonds
13
Heavy Atoms
26
Complexity
239.0
Exact Mass
484.10886
Monoisotopic Mass
484.10886
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 1,6-Bis(beta-phenylethylamino)hexane dihydrobromide

The XLogP value of 5.3672 indicates that 1,6-Bis(beta-phenylethylamino)hexane dihydrobromide is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. With a topological polar surface area (TPSA) of 24.1 Ų, 1,6-Bis(beta-phenylethylamino)hexane dihydrobromide exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, 1,6-Bis(beta-phenylethylamino)hexane dihydrobromide has 4 hydrogen bond donor(s) and 2 hydrogen bond acceptor(s), which may warrant consideration for formulation optimization.

Frequently Asked Questions

What is the CAS number of 1,6-Bis(beta-phenylethylamino)hexane dihydrobromide?

The CAS number of 1,6-Bis(beta-phenylethylamino)hexane dihydrobromide is 1049691-58-8.

What is the molecular formula of 1,6-Bis(beta-phenylethylamino)hexane dihydrobromide?

The molecular formula of 1,6-Bis(beta-phenylethylamino)hexane dihydrobromide is C22H34Br2N2.

What is the molecular weight of 1,6-Bis(beta-phenylethylamino)hexane dihydrobromide?

The molecular weight of 1,6-Bis(beta-phenylethylamino)hexane dihydrobromide is 484.10886 g/mol.

Where can I buy 1,6-Bis(beta-phenylethylamino)hexane dihydrobromide?

You can request a quote for 1,6-Bis(beta-phenylethylamino)hexane dihydrobromide directly from CoreyChem. Contact us or email [email protected] for pricing and availability.

Does CoreyChem offer custom synthesis for 1,6-Bis(beta-phenylethylamino)hexane dihydrobromide?

Yes, CoreyChem provides custom synthesis services for 1,6-Bis(beta-phenylethylamino)hexane dihydrobromide and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.

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