1-(3,4-Pentadien-1-yl)-2,5-pyrrolidinedione
TL;DR: 1-(3,4-Pentadien-1-yl)-2,5-pyrrolidinedione (CAS 81068-32-8) is a chemical compound with molecular formula C9H11NO2 and molecular weight 165.08 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
1-penta-3,4-dienylpyrrolidine-2,5-dione
Also Known As: 2,5-Pyrrolidinedione, 1-penta-3,4-dienyl-, 1-penta-3,4-dienylpyrrolidine-2,5-dione, 1-(3,4-Pentadien-1-yl)-2,5-pyrrolidinedione, 1-(3,4-Pentadienyl)-2,5-pyrrolidinedione, 1-(3,4-Pentadienyl)-2,5-pyrrolidinedione #
| Molecular Formula | C9H11NO2 |
|---|---|
| Molecular Weight | 165.08 g/mol |
| LogP | -0.1 |
| Topological Polar Surface Area | 37.4 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 2 |
| Rotatable Bonds | 3 |
| Exact Mass | 165.07898 |
| Heavy Atoms | 12 |
| Complexity | 235.0 |
Chemical Identifiers
| CAS Number | 81068-32-8 |
|---|---|
| SMILES | C=C=CCCN1C(=O)CCC1=O |
| InChIKey | RJUQADAUTBDNMQ-UHFFFAOYSA-N |
Product Overview
1-(3,4-Pentadien-1-yl)-2,5-pyrrolidinedione (CAS 81068-32-8), with molecular formula C9H11NO2 and molecular weight 165.08 g/mol. IUPAC: 1-penta-3,4-dienylpyrrolidine-2,5-dione.
Chemical Property Profile of 1-(3,4-Pentadien-1-yl)-2,5-pyrrolidinedione
Property Insights of 1-(3,4-Pentadien-1-yl)-2,5-pyrrolidinedione
The XLogP value of -0.1 indicates that 1-(3,4-Pentadien-1-yl)-2,5-pyrrolidinedione is hydrophilic (water-soluble), making it suitable for aqueous formulations and biological assay applications. With a topological polar surface area (TPSA) of 37.4 Ų, 1-(3,4-Pentadien-1-yl)-2,5-pyrrolidinedione exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, 1-(3,4-Pentadien-1-yl)-2,5-pyrrolidinedione 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 1-(3,4-Pentadien-1-yl)-2,5-pyrrolidinedione?
The CAS number of 1-(3,4-Pentadien-1-yl)-2,5-pyrrolidinedione is 81068-32-8.
What is the molecular formula of 1-(3,4-Pentadien-1-yl)-2,5-pyrrolidinedione?
The molecular formula of 1-(3,4-Pentadien-1-yl)-2,5-pyrrolidinedione is C9H11NO2.
What is the molecular weight of 1-(3,4-Pentadien-1-yl)-2,5-pyrrolidinedione?
The molecular weight of 1-(3,4-Pentadien-1-yl)-2,5-pyrrolidinedione is 165.08 g/mol.
Where can I buy 1-(3,4-Pentadien-1-yl)-2,5-pyrrolidinedione?
You can request a quote for 1-(3,4-Pentadien-1-yl)-2,5-pyrrolidinedione directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 1-(3,4-Pentadien-1-yl)-2,5-pyrrolidinedione?
Yes, KEHONG BIO provides custom synthesis services for 1-(3,4-Pentadien-1-yl)-2,5-pyrrolidinedione and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.