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Hexane, 1,6-bis(ethylthio)- structure
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Hexane, 1,6-bis(ethylthio)-

TL;DR: Hexane, 1,6-bis(ethylthio)- (CAS 115412-47-0) is a chemical compound with molecular formula C10H22S2 and molecular weight 206.11629 g/mol, supplied by CoreyChem (Career Henan Chemical Co., Ltd.) with ISO-certified quality and global shipping.

1,6-bis(ethylsulfanyl)hexane

Also Known As: 1,6-diethylthiohexane, 1,6-bis(ethylsulfanyl)hexane, Hexane, 1,6-bis(ethylthio)-, 1,6-bis(ethylthio)hexane

CAS Number
115412-47-0
Molecular Formula
C10H22S2
Molecular Weight
206.11629 g/mol
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Technical Specifications

Molecular FormulaC10H22S2
Molecular Weight206.11629 g/mol
XLogP3.7
Topological Polar Surface Area (TPSA)50.6 Ų
Hydrogen Bond Donors0
Hydrogen Bond Acceptors2
Rotatable Bonds9
Exact Mass206.11629 Da
Heavy Atoms12
Complexity64.0
SMILESCCSCCCCCCSCC
InChIKeyDGWHERIHGCCUJL-UHFFFAOYSA-N

Chemical Property Profile of Hexane, 1,6-bis(ethylthio)-

XLogP
3.7
TPSA (Topological Polar Surface Area)
50.6
Hydrogen Bond Donors
0
Hydrogen Bond Acceptors
2
Rotatable Bonds
9
Heavy Atoms
12
Complexity
64.0
Exact Mass
206.11629
Monoisotopic Mass
206.11629
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 Hexane, 1,6-bis(ethylthio)-

The XLogP value of 3.7 indicates that Hexane, 1,6-bis(ethylthio)- is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. With a topological polar surface area (TPSA) of 50.6 Ų, Hexane, 1,6-bis(ethylthio)- exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, Hexane, 1,6-bis(ethylthio)- 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 Hexane, 1,6-bis(ethylthio)-?

The CAS number of Hexane, 1,6-bis(ethylthio)- is 115412-47-0.

What is the molecular formula of Hexane, 1,6-bis(ethylthio)-?

The molecular formula of Hexane, 1,6-bis(ethylthio)- is C10H22S2.

What is the molecular weight of Hexane, 1,6-bis(ethylthio)-?

The molecular weight of Hexane, 1,6-bis(ethylthio)- is 206.11629 g/mol.

Where can I buy Hexane, 1,6-bis(ethylthio)-?

You can request a quote for Hexane, 1,6-bis(ethylthio)- directly from CoreyChem. Contact us or email [email protected] for pricing and availability.

Does CoreyChem offer custom synthesis for Hexane, 1,6-bis(ethylthio)-?

Yes, CoreyChem provides custom synthesis services for Hexane, 1,6-bis(ethylthio)- and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.

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