6-Phenylhex-2-enal
TL;DR: 6-Phenylhex-2-enal (CAS 55282-87-6) is a chemical compound with molecular formula C12H14O and molecular weight 174.10 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
6-phenylhex-2-enal
Also Known As: 6-phenylhex-2-enal, 6-phenyl-hex-2-enal, 2-Hexenal, 6-phenyl-, (E)-
| Molecular Formula | C12H14O |
|---|---|
| Molecular Weight | 174.10 g/mol |
| LogP | 2.9 |
| Topological Polar Surface Area | 17.1 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 1 |
| Rotatable Bonds | 5 |
| Exact Mass | 174.10446 |
| Heavy Atoms | 13 |
| Complexity | 155.0 |
Chemical Identifiers
| CAS Number | 55282-87-6 |
|---|---|
| SMILES | C1=CC=C(C=C1)CCCC=CC=O |
| InChIKey | JDOAIIWUMRRAQV-UHFFFAOYSA-N |
Patent-Derived Application Labels
Derived from 2 IPC patent classification(s) across the SureChEMBL global patent database.
Product Overview
6-Phenylhex-2-enal (CAS 55282-87-6), with molecular formula C12H14O and molecular weight 174.10 g/mol. IUPAC: 6-phenylhex-2-enal.
Chemical Property Profile of 6-Phenylhex-2-enal
Property Insights of 6-Phenylhex-2-enal
The XLogP value of 2.9 suggests moderate lipophilicity, balancing water solubility and membrane permeability for 6-Phenylhex-2-enal. With a topological polar surface area (TPSA) of 17.1 Ų, 6-Phenylhex-2-enal exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, 6-Phenylhex-2-enal 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 6-Phenylhex-2-enal?
The CAS number of 6-Phenylhex-2-enal is 55282-87-6.
What is the molecular formula of 6-Phenylhex-2-enal?
The molecular formula of 6-Phenylhex-2-enal is C12H14O.
What is the molecular weight of 6-Phenylhex-2-enal?
The molecular weight of 6-Phenylhex-2-enal is 174.10 g/mol.
Where can I buy 6-Phenylhex-2-enal?
You can request a quote for 6-Phenylhex-2-enal directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 6-Phenylhex-2-enal?
Yes, KEHONG BIO provides custom synthesis services for 6-Phenylhex-2-enal and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.