双羟甲脲
TL;DR: 双羟甲脲 (CAS 140-95-4) is a chemical compound with molecular formula C3H8N2O3 and molecular weight 120.05 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
双羟甲脲
1,3-bis(hydroxymethyl)urea
Also Known As: Dimethylolurea, Oxymethurea, 1,3-Bis(hydroxymethyl)urea, Methural, Carbamol
| Molecular Formula | C3H8N2O3 |
|---|---|
| Molecular Weight | 120.05 g/mol |
| LogP | -1.8 |
| Topological Polar Surface Area | 81.6 Ų |
| Hydrogen Bond Donors | 4 |
| Hydrogen Bond Acceptors | 3 |
| Rotatable Bonds | 2 |
| Exact Mass | 120.05349 |
| Heavy Atoms | 8 |
| Complexity | 66.0 |
| Vapor Pressure | 0.00000399 [mmHg] |
Chemical Identifiers
| CAS Number | 140-95-4 |
|---|---|
| SMILES | C(NC(=O)NCO)O |
| InChIKey | QUBQYFYWUJJAAK-UHFFFAOYSA-N |
Patent-Derived Application Labels
Derived from 21 IPC patent classification(s) across the SureChEMBL global patent database.
Product Overview
双羟甲脲 (CAS 140-95-4), with molecular formula C3H8N2O3 and molecular weight 120.05 g/mol. IUPAC: 1,3-bis(hydroxymethyl)urea.
Chemical Property Profile of 双羟甲脲
Property Insights of 双羟甲脲
The XLogP value of -1.8 indicates that 双羟甲脲 is hydrophilic (water-soluble), making it suitable for aqueous formulations and biological assay applications. The TPSA of 81.6 Ų falls within the moderate polarity range, balancing permeability and solubility for 双羟甲脲. Following Lipinski's Rule of Five, 双羟甲脲 has 4 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 双羟甲脲?
The CAS number of 双羟甲脲 is 140-95-4.
What is the molecular formula of 双羟甲脲?
The molecular formula of 双羟甲脲 is C3H8N2O3.
What is the molecular weight of 双羟甲脲?
The molecular weight of 双羟甲脲 is 120.05 g/mol.
Where can I buy 双羟甲脲?
You can request a quote for 双羟甲脲 directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 双羟甲脲?
Yes, KEHONG BIO provides custom synthesis services for 双羟甲脲 and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.