3-Diazopentane-2,4-dione
TL;DR: 3-Diazopentane-2,4-dione (CAS 29397-21-5) is a chemical compound with molecular formula C5H6N2O2 and molecular weight 126.04 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
3-diazopentane-2,4-dione
Also Known As: 3-Diazopentane-2,4-dione, Diacetyldiazomethane, diazo-acetylacetone, 2,4-Pentanedione, 3-diazo-, 3-Diazo-2,4-pentanedione
| Molecular Formula | C5H6N2O2 |
|---|---|
| Molecular Weight | 126.04 g/mol |
| LogP | -0.2 |
| Topological Polar Surface Area | 36.1 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 3 |
| Rotatable Bonds | 2 |
| Exact Mass | 126.04293 |
| Heavy Atoms | 9 |
| Complexity | 185.0 |
Chemical Identifiers
| CAS Number | 29397-21-5 |
|---|---|
| SMILES | CC(=O)C(=[N+]=[N-])C(=O)C |
| InChIKey | PSRWGDPVEXOIFO-UHFFFAOYSA-N |
Patent-Derived Application Labels
Derived from 5 IPC patent classification(s) across the SureChEMBL global patent database.
Product Overview
3-Diazopentane-2,4-dione (CAS 29397-21-5), with molecular formula C5H6N2O2 and molecular weight 126.04 g/mol. IUPAC: 3-diazopentane-2,4-dione.
Chemical Property Profile of 3-Diazopentane-2,4-dione
Property Insights of 3-Diazopentane-2,4-dione
The XLogP value of -0.2 indicates that 3-Diazopentane-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 36.1 Ų, 3-Diazopentane-2,4-dione exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, 3-Diazopentane-2,4-dione has 0 hydrogen bond donor(s) and 3 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 3-Diazopentane-2,4-dione?
The CAS number of 3-Diazopentane-2,4-dione is 29397-21-5.
What is the molecular formula of 3-Diazopentane-2,4-dione?
The molecular formula of 3-Diazopentane-2,4-dione is C5H6N2O2.
What is the molecular weight of 3-Diazopentane-2,4-dione?
The molecular weight of 3-Diazopentane-2,4-dione is 126.04 g/mol.
Where can I buy 3-Diazopentane-2,4-dione?
You can request a quote for 3-Diazopentane-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 3-Diazopentane-2,4-dione?
Yes, KEHONG BIO provides custom synthesis services for 3-Diazopentane-2,4-dione and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.