![Bicyclo[3.1.0]hexane-2,4-dione structure](/static/products/2979/29798-87-6.webp)
Bicyclo[3.1.0]hexane-2,4-dione
TL;DR: Bicyclo[3.1.0]hexane-2,4-dione (CAS 29798-87-6) is a chemical compound with molecular formula C6H6O2 and molecular weight 110.04 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
bicyclo[3.1.0]hexane-2,4-dione
Also Known As: Nicotine-D salicylate, Bicyclo[3.1.0]hexane-2,4-dione, Bicyclo(3.1.0)hexan-2,4-dione, bicyclo(3.1.0)hexan-2,4-dion, Bicyclo[3.1.0]hexan-2,4-dione
| Molecular Formula | C6H6O2 |
|---|---|
| Molecular Weight | 110.04 g/mol |
| LogP | -0.2 |
| Topological Polar Surface Area | 34.1 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 2 |
| Rotatable Bonds | 0 |
| Exact Mass | 110.03678 |
| Heavy Atoms | 8 |
| Complexity | 153.0 |
Chemical Identifiers
| CAS Number | 29798-87-6 |
|---|---|
| SMILES | C1C2C1C(=O)CC2=O |
| InChIKey | WKUPQDDOIJNLLX-UHFFFAOYSA-N |
Patent-Derived Application Labels
Derived from 1 IPC patent classification(s) across the SureChEMBL global patent database.
Product Overview
Bicyclo[3.1.0]hexane-2,4-dione (CAS 29798-87-6), with molecular formula C6H6O2 and molecular weight 110.04 g/mol. IUPAC: bicyclo[3.1.0]hexane-2,4-dione.
Chemical Property Profile of Bicyclo[3.1.0]hexane-2,4-dione
Property Insights of Bicyclo[3.1.0]hexane-2,4-dione
The XLogP value of -0.2 indicates that Bicyclo[3.1.0]hexane-2,4-dione is hydrophilic (water-soluble), making it suitable for aqueous formulations and biological assay applications. With a topological polar surface area (TPSA) of 34.1 Ų, Bicyclo[3.1.0]hexane-2,4-dione exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, Bicyclo[3.1.0]hexane-2,4-dione 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 Bicyclo[3.1.0]hexane-2,4-dione?
The CAS number of Bicyclo[3.1.0]hexane-2,4-dione is 29798-87-6.
What is the molecular formula of Bicyclo[3.1.0]hexane-2,4-dione?
The molecular formula of Bicyclo[3.1.0]hexane-2,4-dione is C6H6O2.
What is the molecular weight of Bicyclo[3.1.0]hexane-2,4-dione?
The molecular weight of Bicyclo[3.1.0]hexane-2,4-dione is 110.04 g/mol.
Where can I buy Bicyclo[3.1.0]hexane-2,4-dione?
You can request a quote for Bicyclo[3.1.0]hexane-2,4-dione directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for Bicyclo[3.1.0]hexane-2,4-dione?
Yes, KEHONG BIO provides custom synthesis services for Bicyclo[3.1.0]hexane-2,4-dione and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.