(E,4S)-hept-2-en-4-ol
TL;DR: (E,4S)-hept-2-en-4-ol (CAS 4798-59-8) is a chemical compound with molecular formula C7H14O and molecular weight 114.10 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
(E,4S)-hept-2-en-4-ol
Also Known As: 2-Hepten-4-ol, (E,4S)-hept-2-en-4-ol, (2E,4S)-hept-2-en-4-ol, [S,E,(+)]-2-Heptene-4-ol
| Molecular Formula | C7H14O |
|---|---|
| Molecular Weight | 114.10 g/mol |
| LogP | 1.7235 |
| Topological Polar Surface Area | 20.23 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 1 |
| Rotatable Bonds | 3 |
| Exact Mass | 114.10446 |
| Heavy Atoms | 8 |
| Complexity | 66.78708 |
Chemical Identifiers
| CAS Number | 4798-59-8 |
|---|---|
| SMILES | CCC[C@@H](/C=C/C)O |
Product Overview
(E,4S)-hept-2-en-4-ol (CAS 4798-59-8), with molecular formula C7H14O and molecular weight 114.10 g/mol. IUPAC: (E,4S)-hept-2-en-4-ol.
Chemical Property Profile of (E,4S)-hept-2-en-4-ol
Property Insights of (E,4S)-hept-2-en-4-ol
The XLogP value of 1.7235 suggests moderate lipophilicity, balancing water solubility and membrane permeability for (E,4S)-hept-2-en-4-ol. With a topological polar surface area (TPSA) of 20.23 Ų, (E,4S)-hept-2-en-4-ol exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, (E,4S)-hept-2-en-4-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 (E,4S)-hept-2-en-4-ol?
The CAS number of (E,4S)-hept-2-en-4-ol is 4798-59-8.
What is the molecular formula of (E,4S)-hept-2-en-4-ol?
The molecular formula of (E,4S)-hept-2-en-4-ol is C7H14O.
What is the molecular weight of (E,4S)-hept-2-en-4-ol?
The molecular weight of (E,4S)-hept-2-en-4-ol is 114.10 g/mol.
Where can I buy (E,4S)-hept-2-en-4-ol?
You can request a quote for (E,4S)-hept-2-en-4-ol directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for (E,4S)-hept-2-en-4-ol?
Yes, KEHONG BIO provides custom synthesis services for (E,4S)-hept-2-en-4-ol and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.