Dodecane, 1-(heptylthio)-
TL;DR: Dodecane, 1-(heptylthio)- (CAS 54934-53-1) is a chemical compound with molecular formula C19H40S and molecular weight 300.29 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
1-heptylsulfanyldodecane
Also Known As: Dodecylheptyl sulfide, Dodecane, 1-(heptylthio)-, 1-heptylsulfanyldodecane, 1-(Heptylsulfanyl)dodecane, 1-(Heptylsulfanyl)dodecane #
| Molecular Formula | C19H40S |
|---|---|
| Molecular Weight | 300.29 g/mol |
| LogP | 9.3 |
| Topological Polar Surface Area | 25.3 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 1 |
| Rotatable Bonds | 17 |
| Exact Mass | 300.28506 |
| Heavy Atoms | 20 |
| Complexity | 156.0 |
Chemical Identifiers
| CAS Number | 54934-53-1 |
|---|---|
| SMILES | CCCCCCCCCCCCSCCCCCCC |
| InChIKey | BMONIUVCBPWHMH-UHFFFAOYSA-N |
Patent-Derived Application Labels
Derived from 2 IPC patent classification(s) across the SureChEMBL global patent database.
Product Overview
Dodecane, 1-(heptylthio)- (CAS 54934-53-1), with molecular formula C19H40S and molecular weight 300.29 g/mol. IUPAC: 1-heptylsulfanyldodecane.
Chemical Property Profile of Dodecane, 1-(heptylthio)-
Property Insights of Dodecane, 1-(heptylthio)-
The XLogP value of 9.3 indicates that Dodecane, 1-(heptylthio)- is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. With a topological polar surface area (TPSA) of 25.3 Ų, Dodecane, 1-(heptylthio)- exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, Dodecane, 1-(heptylthio)- has 0 hydrogen bond donor(s) and 1 hydrogen bond acceptor(s), which may warrant consideration for formulation optimization.
Frequently Asked Questions
Frequently Asked Questions
What is the CAS number of Dodecane, 1-(heptylthio)-?
The CAS number of Dodecane, 1-(heptylthio)- is 54934-53-1.
What is the molecular formula of Dodecane, 1-(heptylthio)-?
The molecular formula of Dodecane, 1-(heptylthio)- is C19H40S.
What is the molecular weight of Dodecane, 1-(heptylthio)-?
The molecular weight of Dodecane, 1-(heptylthio)- is 300.29 g/mol.
Where can I buy Dodecane, 1-(heptylthio)-?
You can request a quote for Dodecane, 1-(heptylthio)- directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for Dodecane, 1-(heptylthio)-?
Yes, KEHONG BIO provides custom synthesis services for Dodecane, 1-(heptylthio)- and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.