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1,4-Bis(diethylamino)-2-butyne structure
Fine Chemical

1,4-Bis(diethylamino)-2-butyne

TL;DR: 1,4-Bis(diethylamino)-2-butyne (CAS 105-18-0) is a chemical compound with molecular formula C12H24N2 and molecular weight 196.19395 g/mol, supplied by CoreyChem (Career Henan Chemical Co., Ltd.) with ISO-certified quality and global shipping.

N,N,N',N'-tetraethylbut-2-yne-1,4-diamine

Also Known As: 1,4-Bis(diethylamino)-2-butyne, Alkylenediamine der., 2-Butyne-1,4-diamine, N,N,N',N'-tetraethyl-, 1,4-Bis (diethylamino)-2-butyne, N,N,N',N'-Tetraethylbut-2-ynylenediamine

CAS Number
105-18-0
Molecular Formula
C12H24N2
Molecular Weight
196.19395 g/mol
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Technical Specifications

Molecular FormulaC12H24N2
Molecular Weight196.19395 g/mol
XLogP1.8
Topological Polar Surface Area (TPSA)6.5 Ų
Hydrogen Bond Donors0
Hydrogen Bond Acceptors2
Rotatable Bonds6
Exact Mass196.19395 Da
Heavy Atoms14
Complexity161.0
SMILESCCN(CC)CC#CCN(CC)CC
InChIKeyZSHOGSSMVWJOGA-UHFFFAOYSA-N

Product Description

Applications: 1,4-Bis(diethylamino)-2-butyne is used in organic synthesis and process chemistry. It commonly serves as a versatile building block for organic synthesis. Available from CoreyChem as both catalog item and custom-synthesis project (mg to ton scale), with full analytical documentation (COA, MSDS, HPLC, NMR, MS).

1,4-Bis(diethylamino)-2-butyne is a fine chemical identified by CAS number 105-18-0 and the molecular formula C12H24N2 and a molecular weight of 196.19 g/mol. Synonyms include 1,4-Bis(diethylamino)-2-butyne and Alkylenediamine der..

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 1,4-Bis(diethylamino)-2-butyne

XLogP
1.8
TPSA (Topological Polar Surface Area)
6.5
Hydrogen Bond Donors
0
Hydrogen Bond Acceptors
2
Rotatable Bonds
6
Heavy Atoms
14
Complexity
161.0
Exact Mass
196.19395
Monoisotopic Mass
196.19395
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 1,4-Bis(diethylamino)-2-butyne

The XLogP value of 1.8 suggests moderate lipophilicity, balancing water solubility and membrane permeability for 1,4-Bis(diethylamino)-2-butyne. With a topological polar surface area (TPSA) of 6.5 Ų, 1,4-Bis(diethylamino)-2-butyne exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, 1,4-Bis(diethylamino)-2-butyne 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 CAS number of 1,4-Bis(diethylamino)-2-butyne?

The CAS number of 1,4-Bis(diethylamino)-2-butyne is 105-18-0.

What is the molecular formula of 1,4-Bis(diethylamino)-2-butyne?

The molecular formula of 1,4-Bis(diethylamino)-2-butyne is C12H24N2.

What is the molecular weight of 1,4-Bis(diethylamino)-2-butyne?

The molecular weight of 1,4-Bis(diethylamino)-2-butyne is 196.19395 g/mol.

What are the applications of 1,4-Bis(diethylamino)-2-butyne?

1,4-Bis(diethylamino)-2-butyne is used in organic synthesis and process chemistry. It commonly serves as a versatile building block for organic synthesis. Available from CoreyChem as both catalog item and custom-synthesis project (mg to ton scale), with full analytical documentation (COA, MSDS,...

Where can I buy 1,4-Bis(diethylamino)-2-butyne?

You can request a quote for 1,4-Bis(diethylamino)-2-butyne directly from CoreyChem. Contact us or email [email protected] for pricing and availability.

Does CoreyChem offer custom synthesis for 1,4-Bis(diethylamino)-2-butyne?

Yes, CoreyChem provides custom synthesis services for 1,4-Bis(diethylamino)-2-butyne and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.

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