5,7-Dodecadiyne
TL;DR: 5,7-Dodecadiyne (CAS 1120-29-2) is a chemical compound with molecular formula CCCCC#CC#CCCCC and molecular weight 162.14 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
dodeca-5,7-diyne
Also Known As: 5,7-Dodecadiyne, dodeca-5,7-diyne, 5,7-dodecadiyne: 5,7-dodecadiyne, n-C4H9C.equiv.CC.equiv.C(n-C4H9), 5,7-DODECADIYNE, 99per cent (STABILIZED WITH 30 0 PPM BHT)
| Molecular Formula | CCCCC#CC#CCCCC |
|---|---|
| Molecular Weight | 162.14 g/mol |
| LogP | 4.8 |
| Topological Polar Surface Area | 0.0 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 0 |
| Rotatable Bonds | 5 |
| Exact Mass | 162.14085 |
| Heavy Atoms | 12 |
| Complexity | 183.0 |
Chemical Identifiers
| CAS Number | 1120-29-2 |
|---|---|
| SMILES | CCCCC#CC#CCCCC |
| InChIKey | KSOQHQONAHQOCM-UHFFFAOYSA-N |
Patent-Derived Application Labels
Derived from 7 IPC patent classification(s) across the SureChEMBL global patent database.
Product Overview
5,7-Dodecadiyne (CAS 1120-29-2), with molecular formula CCCCC#CC#CCCCC and molecular weight 162.14 g/mol. IUPAC: dodeca-5,7-diyne.
Chemical Property Profile of 5,7-Dodecadiyne
Property Insights of 5,7-Dodecadiyne
The XLogP value of 4.8 indicates that 5,7-Dodecadiyne is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. With a topological polar surface area (TPSA) of 0.0 Ų, 5,7-Dodecadiyne exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, 5,7-Dodecadiyne has 0 hydrogen bond donor(s) and 0 hydrogen bond acceptor(s), all within the drug-like range, suggesting favorable oral bioavailability potential.
Frequently Asked Questions
Frequently Asked Questions
What is the CAS number of 5,7-Dodecadiyne?
The CAS number of 5,7-Dodecadiyne is 1120-29-2.
What is the molecular formula of 5,7-Dodecadiyne?
The molecular formula of 5,7-Dodecadiyne is CCCCC#CC#CCCCC.
What is the molecular weight of 5,7-Dodecadiyne?
The molecular weight of 5,7-Dodecadiyne is 162.14 g/mol.
Where can I buy 5,7-Dodecadiyne?
You can request a quote for 5,7-Dodecadiyne directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 5,7-Dodecadiyne?
Yes, KEHONG BIO provides custom synthesis services for 5,7-Dodecadiyne and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.