2-(Phenylmethyl)oxirane
TL;DR: 2-(Phenylmethyl)oxirane (CAS 4436-24-2) 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.
2-benzyloxirane
Also Known As: 2-Benzyloxirane, (2,3-Epoxypropyl)benzene, Benzyloxirane, Allylbenzene oxide, benzene
| Molecular Formula | C9H10O |
|---|---|
| Molecular Weight | 134.07 g/mol |
| LogP | 1.9 |
| Topological Polar Surface Area | 12.5 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 1 |
| Rotatable Bonds | 2 |
| Exact Mass | 134.07317 |
| Heavy Atoms | 10 |
| Complexity | 105.0 |
Chemical Identifiers
| CAS Number | 4436-24-2 |
|---|---|
| SMILES | C1C(O1)CC2=CC=CC=C2 |
| InChIKey | JFDMLXYWGLECEY-UHFFFAOYSA-N |
Patent-Derived Application Labels
Derived from 18 IPC patent classification(s) across the SureChEMBL global patent database.
Product Overview
2-(Phenylmethyl)oxirane (CAS 4436-24-2), with molecular formula C9H10O and molecular weight 134.07 g/mol. IUPAC: 2-benzyloxirane.
Chemical Property Profile of 2-(Phenylmethyl)oxirane
Property Insights of 2-(Phenylmethyl)oxirane
The XLogP value of 1.9 suggests moderate lipophilicity, balancing water solubility and membrane permeability for 2-(Phenylmethyl)oxirane. With a topological polar surface area (TPSA) of 12.5 Ų, 2-(Phenylmethyl)oxirane exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, 2-(Phenylmethyl)oxirane 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 2-(Phenylmethyl)oxirane?
The CAS number of 2-(Phenylmethyl)oxirane is 4436-24-2.
What is the molecular formula of 2-(Phenylmethyl)oxirane?
The molecular formula of 2-(Phenylmethyl)oxirane is C9H10O.
What is the molecular weight of 2-(Phenylmethyl)oxirane?
The molecular weight of 2-(Phenylmethyl)oxirane is 134.07 g/mol.
Where can I buy 2-(Phenylmethyl)oxirane?
You can request a quote for 2-(Phenylmethyl)oxirane directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 2-(Phenylmethyl)oxirane?
Yes, KEHONG BIO provides custom synthesis services for 2-(Phenylmethyl)oxirane and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.