4-Heptenal, 2,5,6-trimethyl-
TL;DR: 4-Heptenal, 2,5,6-trimethyl- (CAS 82784-84-7) is a chemical compound with molecular formula C10H18O and molecular weight 154.14 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
2,5,6-trimethylhept-4-enal
Also Known As: 2,5,6-Trimethylhept-4-enal, 4-Heptenal, 2,5,6-trimethyl-, 2,5,6-trimethyl-4-heptenal, EINECS 280-029-5, RefChem:523572
| Molecular Formula | C10H18O |
|---|---|
| Molecular Weight | 154.14 g/mol |
| LogP | 3.0 |
| Topological Polar Surface Area | 17.1 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 1 |
| Rotatable Bonds | 4 |
| Exact Mass | 154.13577 |
| Heavy Atoms | 11 |
| Complexity | 145.0 |
Chemical Identifiers
| CAS Number | 82784-84-7 |
|---|---|
| SMILES | CC(C)C(=CCC(C)C=O)C |
| InChIKey | XHOFTJRCBBQRFB-UHFFFAOYSA-N |
Patent-Derived Application Labels
Derived from 3 IPC patent classification(s) across the SureChEMBL global patent database.
Product Overview
4-Heptenal, 2,5,6-trimethyl- (CAS 82784-84-7), with molecular formula C10H18O and molecular weight 154.14 g/mol. IUPAC: 2,5,6-trimethylhept-4-enal.
Chemical Property Profile of 4-Heptenal, 2,5,6-trimethyl-
Property Insights of 4-Heptenal, 2,5,6-trimethyl-
The XLogP value of 3.0 indicates that 4-Heptenal, 2,5,6-trimethyl- is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. With a topological polar surface area (TPSA) of 17.1 Ų, 4-Heptenal, 2,5,6-trimethyl- exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, 4-Heptenal, 2,5,6-trimethyl- has 0 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 4-Heptenal, 2,5,6-trimethyl-?
The CAS number of 4-Heptenal, 2,5,6-trimethyl- is 82784-84-7.
What is the molecular formula of 4-Heptenal, 2,5,6-trimethyl-?
The molecular formula of 4-Heptenal, 2,5,6-trimethyl- is C10H18O.
What is the molecular weight of 4-Heptenal, 2,5,6-trimethyl-?
The molecular weight of 4-Heptenal, 2,5,6-trimethyl- is 154.14 g/mol.
Where can I buy 4-Heptenal, 2,5,6-trimethyl-?
You can request a quote for 4-Heptenal, 2,5,6-trimethyl- directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 4-Heptenal, 2,5,6-trimethyl-?
Yes, KEHONG BIO provides custom synthesis services for 4-Heptenal, 2,5,6-trimethyl- and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.