Dodecane, 4-methyl-
TL;DR: Dodecane, 4-methyl- (CAS 6117-97-1) is a chemical compound with molecular formula C13H28 and molecular weight 184.22 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
4-methyldodecane
Also Known As: 4-Methyldodecane, Dodecane, 4-methyl-, 4-methyl-dodecane, VER I, 678-595-7
| Molecular Formula | C13H28 |
|---|---|
| Molecular Weight | 184.22 g/mol |
| LogP | 7.0 |
| Topological Polar Surface Area | 0.0 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 0 |
| Rotatable Bonds | 9 |
| Exact Mass | 184.2191 |
| Heavy Atoms | 13 |
| Complexity | 86.0 |
Chemical Identifiers
| CAS Number | 6117-97-1 |
|---|---|
| SMILES | CCCCCCCCC(C)CCC |
| InChIKey | UZTXSMATBUWDDZ-UHFFFAOYSA-N |
Patent-Derived Application Labels
Derived from 4 IPC patent classification(s) across the SureChEMBL global patent database.
Product Overview
Dodecane, 4-methyl- (CAS 6117-97-1), with molecular formula C13H28 and molecular weight 184.22 g/mol. IUPAC: 4-methyldodecane.
Chemical Property Profile of Dodecane, 4-methyl-
Property Insights of Dodecane, 4-methyl-
The XLogP value of 7.0 indicates that Dodecane, 4-methyl- is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. With a topological polar surface area (TPSA) of 0.0 Ų, Dodecane, 4-methyl- exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, Dodecane, 4-methyl- has 0 hydrogen bond donor(s) and 0 hydrogen bond acceptor(s), which may warrant consideration for formulation optimization.
Frequently Asked Questions
Frequently Asked Questions
What is the CAS number of Dodecane, 4-methyl-?
The CAS number of Dodecane, 4-methyl- is 6117-97-1.
What is the molecular formula of Dodecane, 4-methyl-?
The molecular formula of Dodecane, 4-methyl- is C13H28.
What is the molecular weight of Dodecane, 4-methyl-?
The molecular weight of Dodecane, 4-methyl- is 184.22 g/mol.
Where can I buy Dodecane, 4-methyl-?
You can request a quote for Dodecane, 4-methyl- directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for Dodecane, 4-methyl-?
Yes, KEHONG BIO provides custom synthesis services for Dodecane, 4-methyl- and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.