3-Methylundecane
TL;DR: 3-Methylundecane (CAS 1002-43-3) is a chemical compound with molecular formula C12H26 and molecular weight 170.20 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
3-methylundecane
Also Known As: 3-METHYLUNDECANE, Undecane, 3-methyl-, 2-Ethyl-decane, D-mannose, 3-Methylhendecane
| Molecular Formula | C12H26 |
|---|---|
| Molecular Weight | 170.20 g/mol |
| LogP | 6.4 |
| Topological Polar Surface Area | 0.0 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 0 |
| Rotatable Bonds | 8 |
| Exact Mass | 170.20345 |
| Heavy Atoms | 12 |
| Complexity | 76.0 |
Chemical Identifiers
| CAS Number | 1002-43-3 |
|---|---|
| SMILES | CCCCCCCCC(C)CC |
| InChIKey | HTZWVZNRDDOFEI-UHFFFAOYSA-N |
Patent-Derived Application Labels
Derived from 13 IPC patent classification(s) across the SureChEMBL global patent database.
Product Overview
3-Methylundecane (CAS 1002-43-3), with molecular formula C12H26 and molecular weight 170.20 g/mol. IUPAC: 3-methylundecane.
Chemical Property Profile of 3-Methylundecane
Property Insights of 3-Methylundecane
The XLogP value of 6.4 indicates that 3-Methylundecane is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. With a topological polar surface area (TPSA) of 0.0 Ų, 3-Methylundecane exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, 3-Methylundecane 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 3-Methylundecane?
The CAS number of 3-Methylundecane is 1002-43-3.
What is the molecular formula of 3-Methylundecane?
The molecular formula of 3-Methylundecane is C12H26.
What is the molecular weight of 3-Methylundecane?
The molecular weight of 3-Methylundecane is 170.20 g/mol.
Where can I buy 3-Methylundecane?
You can request a quote for 3-Methylundecane directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 3-Methylundecane?
Yes, KEHONG BIO provides custom synthesis services for 3-Methylundecane and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.