Hepta-4,6-dien-1-OL
TL;DR: Hepta-4,6-dien-1-OL (CAS 55048-74-3) is a chemical compound with molecular formula C7H12O and molecular weight 112.09 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
hepta-4,6-dien-1-ol
Also Known As: HEPTA-4,6-DIEN-1-OL, (E)-4,6-Heptadien-1-ol, 4,6-Heptadien-1-ol, (E)-, 4,6-Heptadien-1-ol, (Z)-
| Molecular Formula | C7H12O |
|---|---|
| Molecular Weight | 112.09 g/mol |
| LogP | 1.6 |
| Topological Polar Surface Area | 20.2 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 1 |
| Rotatable Bonds | 4 |
| Exact Mass | 112.08881 |
| Heavy Atoms | 8 |
| Complexity | 74.0 |
Chemical Identifiers
| CAS Number | 55048-74-3 |
|---|---|
| SMILES | C=CC=CCCCO |
| InChIKey | WNWNZFFQYAFLGP-UHFFFAOYSA-N |
Patent-Derived Application Labels
Derived from 5 IPC patent classification(s) across the SureChEMBL global patent database.
Product Overview
Hepta-4,6-dien-1-OL (CAS 55048-74-3), with molecular formula C7H12O and molecular weight 112.09 g/mol. IUPAC: hepta-4,6-dien-1-ol.
Chemical Property Profile of Hepta-4,6-dien-1-OL
Property Insights of Hepta-4,6-dien-1-OL
The XLogP value of 1.6 suggests moderate lipophilicity, balancing water solubility and membrane permeability for Hepta-4,6-dien-1-OL. With a topological polar surface area (TPSA) of 20.2 Ų, Hepta-4,6-dien-1-OL exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, Hepta-4,6-dien-1-OL has 1 hydrogen bond donor(s) and 1 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 Hepta-4,6-dien-1-OL?
The CAS number of Hepta-4,6-dien-1-OL is 55048-74-3.
What is the molecular formula of Hepta-4,6-dien-1-OL?
The molecular formula of Hepta-4,6-dien-1-OL is C7H12O.
What is the molecular weight of Hepta-4,6-dien-1-OL?
The molecular weight of Hepta-4,6-dien-1-OL is 112.09 g/mol.
Where can I buy Hepta-4,6-dien-1-OL?
You can request a quote for Hepta-4,6-dien-1-OL directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for Hepta-4,6-dien-1-OL?
Yes, KEHONG BIO provides custom synthesis services for Hepta-4,6-dien-1-OL and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.