![(2-Oxa-3-azabicyclo[2.2.1]hept-5-en-3-yl)-phenylmethanone structure](/static/products/5943/59438-62-9.webp)
(2-Oxa-3-azabicyclo[2.2.1]hept-5-en-3-yl)-phenylmethanone
TL;DR: (2-Oxa-3-azabicyclo[2.2.1]hept-5-en-3-yl)-phenylmethanone (CAS 59438-62-9) is a chemical compound with molecular formula C12H11NO2 and molecular weight 201.08 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
2-oxa-3-azabicyclo[2.2.1]hept-5-en-3-yl(phenyl)methanone
Also Known As: (2-Oxa-3-azabicyclo[2.2.1]hept-5-en-3-yl)-phenylmethanone, 2-Benzoyl-3-oxa-2-azabicyclo[2.2.1]heptane-5-ene, 3-Benzoyl-2-oxa-3-azabicyclo[2.2.1]heptane-5-ene, 3-oxa-2-azabicyclo[2.2.1]hept-5-en-2-yl(phenyl)methanone, (2-Oxa-3-azabicyclo[2.2.1]hept-5-en-3-yl)phenyl ketone
| Molecular Formula | C12H11NO2 |
|---|---|
| Molecular Weight | 201.08 g/mol |
| LogP | 1.9 |
| Topological Polar Surface Area | 29.5 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 2 |
| Rotatable Bonds | 1 |
| Exact Mass | 201.07898 |
| Heavy Atoms | 15 |
| Complexity | 294.0 |
Chemical Identifiers
| CAS Number | 59438-62-9 |
|---|---|
| SMILES | C1C2C=CC1ON2C(=O)C3=CC=CC=C3 |
| InChIKey | RGQWWSKLLHCKFI-UHFFFAOYSA-N |
Product Overview
(2-Oxa-3-azabicyclo[2.2.1]hept-5-en-3-yl)-phenylmethanone (CAS 59438-62-9), with molecular formula C12H11NO2 and molecular weight 201.08 g/mol. IUPAC: 2-oxa-3-azabicyclo[2.2.1]hept-5-en-3-yl(phenyl)methanone.
Chemical Property Profile of (2-Oxa-3-azabicyclo[2.2.1]hept-5-en-3-yl)-phenylmethanone
Property Insights of (2-Oxa-3-azabicyclo[2.2.1]hept-5-en-3-yl)-phenylmethanone
The XLogP value of 1.9 suggests moderate lipophilicity, balancing water solubility and membrane permeability for (2-Oxa-3-azabicyclo[2.2.1]hept-5-en-3-yl)-phenylmethanone. With a topological polar surface area (TPSA) of 29.5 Ų, (2-Oxa-3-azabicyclo[2.2.1]hept-5-en-3-yl)-phenylmethanone exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, (2-Oxa-3-azabicyclo[2.2.1]hept-5-en-3-yl)-phenylmethanone has 0 hydrogen bond donor(s) and 2 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-Oxa-3-azabicyclo[2.2.1]hept-5-en-3-yl)-phenylmethanone?
The CAS number of (2-Oxa-3-azabicyclo[2.2.1]hept-5-en-3-yl)-phenylmethanone is 59438-62-9.
What is the molecular formula of (2-Oxa-3-azabicyclo[2.2.1]hept-5-en-3-yl)-phenylmethanone?
The molecular formula of (2-Oxa-3-azabicyclo[2.2.1]hept-5-en-3-yl)-phenylmethanone is C12H11NO2.
What is the molecular weight of (2-Oxa-3-azabicyclo[2.2.1]hept-5-en-3-yl)-phenylmethanone?
The molecular weight of (2-Oxa-3-azabicyclo[2.2.1]hept-5-en-3-yl)-phenylmethanone is 201.08 g/mol.
Where can I buy (2-Oxa-3-azabicyclo[2.2.1]hept-5-en-3-yl)-phenylmethanone?
You can request a quote for (2-Oxa-3-azabicyclo[2.2.1]hept-5-en-3-yl)-phenylmethanone directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for (2-Oxa-3-azabicyclo[2.2.1]hept-5-en-3-yl)-phenylmethanone?
Yes, KEHONG BIO provides custom synthesis services for (2-Oxa-3-azabicyclo[2.2.1]hept-5-en-3-yl)-phenylmethanone and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.