Hept-3-ene-1,7-diol
TL;DR: Hept-3-ene-1,7-diol (CAS 84143-36-2) is a chemical compound with molecular formula C7H14O2 and molecular weight 130.10 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
hept-3-ene-1,7-diol
Also Known As: hept-3-ene-1,7-diol, 1,7-DIHYDROXYHEPTENE-3
| Molecular Formula | C7H14O2 |
|---|---|
| Molecular Weight | 130.10 g/mol |
| LogP | 0.4 |
| Topological Polar Surface Area | 40.5 Ų |
| Hydrogen Bond Donors | 2 |
| Hydrogen Bond Acceptors | 2 |
| Rotatable Bonds | 5 |
| Exact Mass | 130.09938 |
| Heavy Atoms | 9 |
| Complexity | 69.0 |
Chemical Identifiers
| CAS Number | 84143-36-2 |
|---|---|
| SMILES | C(CC=CCCO)CO |
| InChIKey | DOOJAFNLRWSMQE-UHFFFAOYSA-N |
Patent-Derived Application Labels
Derived from 6 IPC patent classification(s) across the SureChEMBL global patent database.
Product Overview
Hept-3-ene-1,7-diol (CAS 84143-36-2), with molecular formula C7H14O2 and molecular weight 130.10 g/mol. IUPAC: hept-3-ene-1,7-diol.
Chemical Property Profile of Hept-3-ene-1,7-diol
Property Insights of Hept-3-ene-1,7-diol
The XLogP value of 0.4 suggests moderate lipophilicity, balancing water solubility and membrane permeability for Hept-3-ene-1,7-diol. With a topological polar surface area (TPSA) of 40.5 Ų, Hept-3-ene-1,7-diol exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, Hept-3-ene-1,7-diol has 2 hydrogen bond donor(s) and 2 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 Hept-3-ene-1,7-diol?
The CAS number of Hept-3-ene-1,7-diol is 84143-36-2.
What is the molecular formula of Hept-3-ene-1,7-diol?
The molecular formula of Hept-3-ene-1,7-diol is C7H14O2.
What is the molecular weight of Hept-3-ene-1,7-diol?
The molecular weight of Hept-3-ene-1,7-diol is 130.10 g/mol.
Where can I buy Hept-3-ene-1,7-diol?
You can request a quote for Hept-3-ene-1,7-diol directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for Hept-3-ene-1,7-diol?
Yes, KEHONG BIO provides custom synthesis services for Hept-3-ene-1,7-diol and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.