1-Methoxycyclohexene
TL;DR: 1-Methoxycyclohexene (CAS 931-57-7) is a chemical compound with molecular formula C7H12O and molecular weight 112.09 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
1-methoxycyclohexene
Also Known As: 1-Methoxycyclohexene, 1-methoxycyclohex-1-ene, Cyclohexene, 1-methoxy-, 1-Methoxy-1-cyclohexene, 1-methoxy-cyclohexene
| Molecular Formula | C7H12O |
|---|---|
| Molecular Weight | 112.09 g/mol |
| LogP | 2.0 |
| Topological Polar Surface Area | 9.2 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 1 |
| Rotatable Bonds | 1 |
| Exact Mass | 112.08881 |
| Heavy Atoms | 8 |
| Complexity | 94.0 |
Chemical Identifiers
| CAS Number | 931-57-7 |
|---|---|
| SMILES | COC1=CCCCC1 |
| InChIKey | HZFQGYWRFABYSR-UHFFFAOYSA-N |
Patent-Derived Application Labels
Derived from 16 IPC patent classification(s) across the SureChEMBL global patent database.
Product Overview
1-Methoxycyclohexene (CAS 931-57-7), with molecular formula C7H12O and molecular weight 112.09 g/mol. IUPAC: 1-methoxycyclohexene.
Chemical Property Profile of 1-Methoxycyclohexene
Property Insights of 1-Methoxycyclohexene
The XLogP value of 2.0 suggests moderate lipophilicity, balancing water solubility and membrane permeability for 1-Methoxycyclohexene. With a topological polar surface area (TPSA) of 9.2 Ų, 1-Methoxycyclohexene exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, 1-Methoxycyclohexene 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 1-Methoxycyclohexene?
The CAS number of 1-Methoxycyclohexene is 931-57-7.
What is the molecular formula of 1-Methoxycyclohexene?
The molecular formula of 1-Methoxycyclohexene is C7H12O.
What is the molecular weight of 1-Methoxycyclohexene?
The molecular weight of 1-Methoxycyclohexene is 112.09 g/mol.
Where can I buy 1-Methoxycyclohexene?
You can request a quote for 1-Methoxycyclohexene directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 1-Methoxycyclohexene?
Yes, KEHONG BIO provides custom synthesis services for 1-Methoxycyclohexene and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.