(E,3R)-4-methylhept-4-en-3-ol
TL;DR: (E,3R)-4-methylhept-4-en-3-ol (CAS 81280-12-8) is a chemical compound with molecular formula C8H16O and molecular weight 128.12 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
(E,3R)-4-methylhept-4-en-3-ol
Also Known As: 4-Methyl-4-hepten-3-ol, (3R)-4-methylhept-4-en-3-ol, (R)-1-Ethyl-2-methyl-2-pentene-1-ol, J3.558.090E
| Molecular Formula | C8H16O |
|---|---|
| Molecular Weight | 128.12 g/mol |
| LogP | 2.1136 |
| Topological Polar Surface Area | 20.23 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 1 |
| Rotatable Bonds | 3 |
| Exact Mass | 128.12012 |
| Heavy Atoms | 9 |
| Complexity | 94.74076 |
Chemical Identifiers
| CAS Number | 81280-12-8 |
|---|---|
| SMILES | CC/C=C(\C)/[C@@H](CC)O |
Product Overview
(E,3R)-4-methylhept-4-en-3-ol (CAS 81280-12-8), with molecular formula C8H16O and molecular weight 128.12 g/mol. IUPAC: (E,3R)-4-methylhept-4-en-3-ol.
Chemical Property Profile of (E,3R)-4-methylhept-4-en-3-ol
Property Insights of (E,3R)-4-methylhept-4-en-3-ol
The XLogP value of 2.1136 suggests moderate lipophilicity, balancing water solubility and membrane permeability for (E,3R)-4-methylhept-4-en-3-ol. With a topological polar surface area (TPSA) of 20.23 Ų, (E,3R)-4-methylhept-4-en-3-ol exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, (E,3R)-4-methylhept-4-en-3-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,3R)-4-methylhept-4-en-3-ol?
The CAS number of (E,3R)-4-methylhept-4-en-3-ol is 81280-12-8.
What is the molecular formula of (E,3R)-4-methylhept-4-en-3-ol?
The molecular formula of (E,3R)-4-methylhept-4-en-3-ol is C8H16O.
What is the molecular weight of (E,3R)-4-methylhept-4-en-3-ol?
The molecular weight of (E,3R)-4-methylhept-4-en-3-ol is 128.12 g/mol.
Where can I buy (E,3R)-4-methylhept-4-en-3-ol?
You can request a quote for (E,3R)-4-methylhept-4-en-3-ol directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for (E,3R)-4-methylhept-4-en-3-ol?
Yes, KEHONG BIO provides custom synthesis services for (E,3R)-4-methylhept-4-en-3-ol and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.