1-Vinylbenzene-3,4-oxide
TL;DR: 1-Vinylbenzene-3,4-oxide (CAS 78619-09-7) is a chemical compound with molecular formula C8H8O and molecular weight 120.06 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
3-ethenyl-7-oxabicyclo[4.1.0]hepta-2,4-diene
Also Known As: 1-Vinylbenzene-3,4-oxide, 1-Vinylbenzene 3,4-oxide, 3-Vinyl-7-oxabicyclo(4.1.0)hepta-2,4-diene, 3-ethenyl-7-oxabicyclo[4.1.0]hepta-2,4-diene, 4-ethenyl-7-oxabicyclo[4.1.0]hepta-2,4-diene
| Molecular Formula | C8H8O |
|---|---|
| Molecular Weight | 120.06 g/mol |
| LogP | 1.436 |
| Topological Polar Surface Area | 12.53 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 1 |
| Rotatable Bonds | 1 |
| Exact Mass | 120.05752 |
| Heavy Atoms | 9 |
| Complexity | 200.61317 |
Chemical Identifiers
| CAS Number | 78619-09-7 |
|---|---|
| SMILES | C=CC1=CC2C(O2)C=C1 |
Product Overview
1-Vinylbenzene-3,4-oxide (CAS 78619-09-7), with molecular formula C8H8O and molecular weight 120.06 g/mol. IUPAC: 3-ethenyl-7-oxabicyclo[4.1.0]hepta-2,4-diene.
Chemical Property Profile of 1-Vinylbenzene-3,4-oxide
Property Insights of 1-Vinylbenzene-3,4-oxide
The XLogP value of 1.436 suggests moderate lipophilicity, balancing water solubility and membrane permeability for 1-Vinylbenzene-3,4-oxide. With a topological polar surface area (TPSA) of 12.53 Ų, 1-Vinylbenzene-3,4-oxide exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, 1-Vinylbenzene-3,4-oxide 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-Vinylbenzene-3,4-oxide?
The CAS number of 1-Vinylbenzene-3,4-oxide is 78619-09-7.
What is the molecular formula of 1-Vinylbenzene-3,4-oxide?
The molecular formula of 1-Vinylbenzene-3,4-oxide is C8H8O.
What is the molecular weight of 1-Vinylbenzene-3,4-oxide?
The molecular weight of 1-Vinylbenzene-3,4-oxide is 120.06 g/mol.
Where can I buy 1-Vinylbenzene-3,4-oxide?
You can request a quote for 1-Vinylbenzene-3,4-oxide directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 1-Vinylbenzene-3,4-oxide?
Yes, KEHONG BIO provides custom synthesis services for 1-Vinylbenzene-3,4-oxide and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.