4-Methoxy-trans-beta-chlorostyrene
TL;DR: 4-Methoxy-trans-beta-chlorostyrene (CAS 18684-94-1) is a chemical compound with molecular formula C9H9ClO and molecular weight 168.03 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
1-[(E)-2-chloroethenyl]-4-methoxybenzene
Also Known As: 4-Methoxy-trans-beta-chlorostyrene, 4-(2-Chlorovinyl)anisole, beta-Chloro-4-methoxystyrene, trans-beta-Chloro-4-methoxystyrene, 1-[(E)-2-chloroethenyl]-4-methoxybenzene
| Molecular Formula | C9H9ClO |
|---|---|
| Molecular Weight | 168.03 g/mol |
| LogP | 2.9047 |
| Topological Polar Surface Area | 9.23 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 1 |
| Rotatable Bonds | 2 |
| Exact Mass | 168.0342 |
| Heavy Atoms | 11 |
| Complexity | 238.24457 |
Chemical Identifiers
| CAS Number | 18684-94-1 |
|---|---|
| SMILES | COC1=CC=C(C=C1)/C=C/Cl |
Product Overview
4-Methoxy-trans-beta-chlorostyrene (CAS 18684-94-1), with molecular formula C9H9ClO and molecular weight 168.03 g/mol. IUPAC: 1-[(E)-2-chloroethenyl]-4-methoxybenzene.
Chemical Property Profile of 4-Methoxy-trans-beta-chlorostyrene
Property Insights of 4-Methoxy-trans-beta-chlorostyrene
The XLogP value of 2.9047 suggests moderate lipophilicity, balancing water solubility and membrane permeability for 4-Methoxy-trans-beta-chlorostyrene. With a topological polar surface area (TPSA) of 9.23 Ų, 4-Methoxy-trans-beta-chlorostyrene exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, 4-Methoxy-trans-beta-chlorostyrene 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 4-Methoxy-trans-beta-chlorostyrene?
The CAS number of 4-Methoxy-trans-beta-chlorostyrene is 18684-94-1.
What is the molecular formula of 4-Methoxy-trans-beta-chlorostyrene?
The molecular formula of 4-Methoxy-trans-beta-chlorostyrene is C9H9ClO.
What is the molecular weight of 4-Methoxy-trans-beta-chlorostyrene?
The molecular weight of 4-Methoxy-trans-beta-chlorostyrene is 168.03 g/mol.
Where can I buy 4-Methoxy-trans-beta-chlorostyrene?
You can request a quote for 4-Methoxy-trans-beta-chlorostyrene directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 4-Methoxy-trans-beta-chlorostyrene?
Yes, KEHONG BIO provides custom synthesis services for 4-Methoxy-trans-beta-chlorostyrene and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.