Hepta-2,4-dienal
TL;DR: Hepta-2,4-dienal (CAS 4313-03-5) is a chemical compound with molecular formula C7H10O and molecular weight 110.07 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
hepta-2,4-dienal
Also Known As: hepta-2,4-dienal, Heptadienal, 2,4-HEPTADIENAL, trans,trans-2,4-Heptadienal, 2,4-Heptdienal
| Molecular Formula | C7H10O |
|---|---|
| Molecular Weight | 110.07 g/mol |
| LogP | 1.6 |
| Topological Polar Surface Area | 17.1 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 1 |
| Rotatable Bonds | 3 |
| Exact Mass | 110.073166 |
| Heavy Atoms | 8 |
| Complexity | 101.0 |
Chemical Identifiers
| CAS Number | 4313-03-5 |
|---|---|
| SMILES | CCC=CC=CC=O |
| InChIKey | SATICYYAWWYRAM-UHFFFAOYSA-N |
Patent-Derived Application Labels
Derived from 14 IPC patent classification(s) across the SureChEMBL global patent database.
Product Overview
Hepta-2,4-dienal (CAS 4313-03-5), with molecular formula C7H10O and molecular weight 110.07 g/mol. IUPAC: hepta-2,4-dienal.
Chemical Property Profile of Hepta-2,4-dienal
Property Insights of Hepta-2,4-dienal
The XLogP value of 1.6 suggests moderate lipophilicity, balancing water solubility and membrane permeability for Hepta-2,4-dienal. With a topological polar surface area (TPSA) of 17.1 Ų, Hepta-2,4-dienal exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, Hepta-2,4-dienal 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 Hepta-2,4-dienal?
The CAS number of Hepta-2,4-dienal is 4313-03-5.
What is the molecular formula of Hepta-2,4-dienal?
The molecular formula of Hepta-2,4-dienal is C7H10O.
What is the molecular weight of Hepta-2,4-dienal?
The molecular weight of Hepta-2,4-dienal is 110.07 g/mol.
Where can I buy Hepta-2,4-dienal?
You can request a quote for Hepta-2,4-dienal directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for Hepta-2,4-dienal?
Yes, KEHONG BIO provides custom synthesis services for Hepta-2,4-dienal and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.