1,2-Propylene urea
TL;DR: 1,2-Propylene urea (CAS 6531-31-3) is a chemical compound with molecular formula C4H8N2O and molecular weight 100.06 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
4-methylimidazolidin-2-one
Also Known As: 4-Methylimidazolidin-2-one, 4-Methyl-2-imidazolidinone, Propylene urea, Propyleneurea, 1,2-Propylene urea
| Molecular Formula | C4H8N2O |
|---|---|
| Molecular Weight | 100.06 g/mol |
| LogP | -0.4 |
| Topological Polar Surface Area | 41.1 Ų |
| Hydrogen Bond Donors | 2 |
| Hydrogen Bond Acceptors | 1 |
| Rotatable Bonds | 0 |
| Exact Mass | 100.06366 |
| Heavy Atoms | 7 |
| Complexity | 91.0 |
Chemical Identifiers
| CAS Number | 6531-31-3 |
|---|---|
| SMILES | CC1CNC(=O)N1 |
| InChIKey | DWEQVNFWAKJCEY-UHFFFAOYSA-N |
Patent-Derived Application Labels
Derived from 21 IPC patent classification(s) across the SureChEMBL global patent database.
Product Overview
1,2-Propylene urea (CAS 6531-31-3), with molecular formula C4H8N2O and molecular weight 100.06 g/mol. IUPAC: 4-methylimidazolidin-2-one.
Chemical Property Profile of 1,2-Propylene urea
Property Insights of 1,2-Propylene urea
The XLogP value of -0.4 indicates that 1,2-Propylene urea is hydrophilic (water-soluble), making it suitable for aqueous formulations and biological assay applications. With a topological polar surface area (TPSA) of 41.1 Ų, 1,2-Propylene urea exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, 1,2-Propylene urea has 2 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 1,2-Propylene urea?
The CAS number of 1,2-Propylene urea is 6531-31-3.
What is the molecular formula of 1,2-Propylene urea?
The molecular formula of 1,2-Propylene urea is C4H8N2O.
What is the molecular weight of 1,2-Propylene urea?
The molecular weight of 1,2-Propylene urea is 100.06 g/mol.
Where can I buy 1,2-Propylene urea?
You can request a quote for 1,2-Propylene urea directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 1,2-Propylene urea?
Yes, KEHONG BIO provides custom synthesis services for 1,2-Propylene urea and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.