1-(Cyclopent-1-en-1-yl)-3-methoxybenzene
TL;DR: 1-(Cyclopent-1-en-1-yl)-3-methoxybenzene (CAS 36967-94-9) 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.
1-(cyclopenten-1-yl)-3-methoxybenzene
Also Known As: 1-(cyclopent-1-en-1-yl)-3-methoxybenzene, 1-(3-Methoxyphenyl)-cyclopenten, 1-(cyclopenten-1-yl)-3-methoxybenzene, 1-(3-methoxyphenyl) cyclopentene, KST-1B3657
| Molecular Formula | C12H14O |
|---|---|
| Molecular Weight | 174.10 g/mol |
| LogP | 3.1 |
| Topological Polar Surface Area | 9.2 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 1 |
| Rotatable Bonds | 2 |
| Exact Mass | 174.10446 |
| Heavy Atoms | 13 |
| Complexity | 195.0 |
Chemical Identifiers
| CAS Number | 36967-94-9 |
|---|---|
| SMILES | COC1=CC=CC(=C1)C2=CCCC2 |
| InChIKey | BCDTYFAPZNYGHN-UHFFFAOYSA-N |
Patent-Derived Application Labels
Derived from 3 IPC patent classification(s) across the SureChEMBL global patent database.
Product Overview
1-(Cyclopent-1-en-1-yl)-3-methoxybenzene (CAS 36967-94-9), with molecular formula C12H14O and molecular weight 174.10 g/mol. IUPAC: 1-(cyclopenten-1-yl)-3-methoxybenzene.
Chemical Property Profile of 1-(Cyclopent-1-en-1-yl)-3-methoxybenzene
Property Insights of 1-(Cyclopent-1-en-1-yl)-3-methoxybenzene
The XLogP value of 3.1 indicates that 1-(Cyclopent-1-en-1-yl)-3-methoxybenzene is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. With a topological polar surface area (TPSA) of 9.2 Ų, 1-(Cyclopent-1-en-1-yl)-3-methoxybenzene exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, 1-(Cyclopent-1-en-1-yl)-3-methoxybenzene 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-(Cyclopent-1-en-1-yl)-3-methoxybenzene?
The CAS number of 1-(Cyclopent-1-en-1-yl)-3-methoxybenzene is 36967-94-9.
What is the molecular formula of 1-(Cyclopent-1-en-1-yl)-3-methoxybenzene?
The molecular formula of 1-(Cyclopent-1-en-1-yl)-3-methoxybenzene is C12H14O.
What is the molecular weight of 1-(Cyclopent-1-en-1-yl)-3-methoxybenzene?
The molecular weight of 1-(Cyclopent-1-en-1-yl)-3-methoxybenzene is 174.10 g/mol.
Where can I buy 1-(Cyclopent-1-en-1-yl)-3-methoxybenzene?
You can request a quote for 1-(Cyclopent-1-en-1-yl)-3-methoxybenzene directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 1-(Cyclopent-1-en-1-yl)-3-methoxybenzene?
Yes, KEHONG BIO provides custom synthesis services for 1-(Cyclopent-1-en-1-yl)-3-methoxybenzene and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.