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RefChem:368830 structure
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RefChem:368830

TL;DR: RefChem:368830 (CAS 16793-51-4) is a chemical compound with molecular formula C15H24Cl3NO and molecular weight 339.09235 g/mol, supplied by CoreyChem (Career Henan Chemical Co., Ltd.) with ISO-certified quality and global shipping.

N-(2-chloroethyl)-2-(4-chloro-5-methyl-2-propan-2-ylphenoxy)-N-methylethanamine;hydrochloride

Also Known As: WV 0010, Phenetole, 4-chloro-beta-(N-(2-chloroethyl)-N-methylamino)-2-isopropyl-5-methyl-, hydrochloride, 4-Chloro-beta-(N-(2-chloroethyl)-N-methylamino)-2-isopropyl-5-methylphenetole hydrochloride, p-Cymene, 2-chloro-5-(2-(N-(2-chloroethyl)-N-methylamino)ethoxy)-, hydrochloride, Diethylamine, 2-chloro-2'-[(6-chlorothymyl)oxy]-N-methyl-, hydrochloride

CAS Number
16793-51-4
Molecular Formula
C15H24Cl3NO
Molecular Weight
339.09235 g/mol
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Technical Specifications

Molecular FormulaC15H24Cl3NO
Molecular Weight339.09235 g/mol
XLogP4.74302
Topological Polar Surface Area (TPSA)12.5 Ų
Hydrogen Bond Donors1
Hydrogen Bond Acceptors2
Rotatable Bonds7
Exact Mass339.09235 Da
Heavy Atoms20
Complexity250.0
SMILESCC1=CC(=C(C=C1Cl)C(C)C)OCCN(C)CCCl.Cl
InChIKeyKOELOQAHVZOIRM-UHFFFAOYSA-N

Chemical Property Profile of RefChem:368830

XLogP
4.74302
TPSA (Topological Polar Surface Area)
12.5
Hydrogen Bond Donors
1
Hydrogen Bond Acceptors
2
Rotatable Bonds
7
Heavy Atoms
20
Complexity
250.0
Exact Mass
339.09235
Monoisotopic Mass
339.09235
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 RefChem:368830

The XLogP value of 4.74302 indicates that RefChem:368830 is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. With a topological polar surface area (TPSA) of 12.5 Ų, RefChem:368830 exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, RefChem:368830 has 1 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 CAS number of RefChem:368830?

The CAS number of RefChem:368830 is 16793-51-4.

What is the molecular formula of RefChem:368830?

The molecular formula of RefChem:368830 is C15H24Cl3NO.

What is the molecular weight of RefChem:368830?

The molecular weight of RefChem:368830 is 339.09235 g/mol.

Where can I buy RefChem:368830?

You can request a quote for RefChem:368830 directly from CoreyChem. Contact us or email [email protected] for pricing and availability.

Does CoreyChem offer custom synthesis for RefChem:368830?

Yes, CoreyChem provides custom synthesis services for RefChem:368830 and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.

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