3-Cyclohexene-1-propanal
TL;DR: 3-Cyclohexene-1-propanal (CAS 22858-74-8) is a chemical compound with molecular formula C9H14O and molecular weight 138.10 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
3-cyclohex-3-en-1-ylpropanal
Also Known As: 3-Cyclohexene-1-propanal, 3- propanal, 3-(3-Cyclohexenyl)propanal, 3-cyclohex-3-en-1-ylpropanal, 3-(cyclohex-3-en-1-yl)propanal
| Molecular Formula | C9H14O |
|---|---|
| Molecular Weight | 138.10 g/mol |
| LogP | 2.0 |
| Topological Polar Surface Area | 17.1 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 1 |
| Rotatable Bonds | 3 |
| Exact Mass | 138.10446 |
| Heavy Atoms | 10 |
| Complexity | 127.0 |
Chemical Identifiers
| CAS Number | 22858-74-8 |
|---|---|
| SMILES | C1CC(CC=C1)CCC=O |
| InChIKey | OXUBYKXQGDQVQR-UHFFFAOYSA-N |
Patent-Derived Application Labels
Derived from 4 IPC patent classification(s) across the SureChEMBL global patent database.
Product Overview
3-Cyclohexene-1-propanal (CAS 22858-74-8), with molecular formula C9H14O and molecular weight 138.10 g/mol. IUPAC: 3-cyclohex-3-en-1-ylpropanal.
Chemical Property Profile of 3-Cyclohexene-1-propanal
Property Insights of 3-Cyclohexene-1-propanal
The XLogP value of 2.0 suggests moderate lipophilicity, balancing water solubility and membrane permeability for 3-Cyclohexene-1-propanal. With a topological polar surface area (TPSA) of 17.1 Ų, 3-Cyclohexene-1-propanal exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, 3-Cyclohexene-1-propanal 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 3-Cyclohexene-1-propanal?
The CAS number of 3-Cyclohexene-1-propanal is 22858-74-8.
What is the molecular formula of 3-Cyclohexene-1-propanal?
The molecular formula of 3-Cyclohexene-1-propanal is C9H14O.
What is the molecular weight of 3-Cyclohexene-1-propanal?
The molecular weight of 3-Cyclohexene-1-propanal is 138.10 g/mol.
Where can I buy 3-Cyclohexene-1-propanal?
You can request a quote for 3-Cyclohexene-1-propanal directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 3-Cyclohexene-1-propanal?
Yes, KEHONG BIO provides custom synthesis services for 3-Cyclohexene-1-propanal and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.