Benzene, (1-methoxyethenyl)-
TL;DR: Benzene, (1-methoxyethenyl)- (CAS 4747-13-1) is a chemical compound with molecular formula C9H10O and molecular weight 134.07 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
1-methoxyethenylbenzene
Also Known As: alpha-Methoxystyrene, (1-methoxyvinyl)benzene, 1-methoxyethenylbenzene, Benzene, (1-methoxyethenyl)-, 1-Methoxyvinylbenzene
| Molecular Formula | C9H10O |
|---|---|
| Molecular Weight | 134.07 g/mol |
| LogP | 2.5 |
| Topological Polar Surface Area | 9.2 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 1 |
| Rotatable Bonds | 2 |
| Exact Mass | 134.07317 |
| Heavy Atoms | 10 |
| Complexity | 112.0 |
Chemical Identifiers
| CAS Number | 4747-13-1 |
|---|---|
| SMILES | COC(=C)C1=CC=CC=C1 |
| InChIKey | SIZDIMDMQQFWLM-UHFFFAOYSA-N |
Patent-Derived Application Labels
Derived from 12 IPC patent classification(s) across the SureChEMBL global patent database.
Product Overview
Benzene, (1-methoxyethenyl)- (CAS 4747-13-1), with molecular formula C9H10O and molecular weight 134.07 g/mol. IUPAC: 1-methoxyethenylbenzene.
Chemical Property Profile of Benzene, (1-methoxyethenyl)-
Property Insights of Benzene, (1-methoxyethenyl)-
The XLogP value of 2.5 suggests moderate lipophilicity, balancing water solubility and membrane permeability for Benzene, (1-methoxyethenyl)-. With a topological polar surface area (TPSA) of 9.2 Ų, Benzene, (1-methoxyethenyl)- exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, Benzene, (1-methoxyethenyl)- 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 Benzene, (1-methoxyethenyl)-?
The CAS number of Benzene, (1-methoxyethenyl)- is 4747-13-1.
What is the molecular formula of Benzene, (1-methoxyethenyl)-?
The molecular formula of Benzene, (1-methoxyethenyl)- is C9H10O.
What is the molecular weight of Benzene, (1-methoxyethenyl)-?
The molecular weight of Benzene, (1-methoxyethenyl)- is 134.07 g/mol.
Where can I buy Benzene, (1-methoxyethenyl)-?
You can request a quote for Benzene, (1-methoxyethenyl)- directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for Benzene, (1-methoxyethenyl)-?
Yes, KEHONG BIO provides custom synthesis services for Benzene, (1-methoxyethenyl)- and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.