3-(3-Hydroxyphenyl)-1,1-dimethylurea
TL;DR: 3-(3-Hydroxyphenyl)-1,1-dimethylurea (CAS 4849-46-1) is a chemical compound with molecular formula C9H12N2O2 and molecular weight 180.09 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
3-(3-hydroxyphenyl)-1,1-dimethylurea
Also Known As: 3-Hydroxyfenuron, 3-(3-hydroxyphenyl)-1,1-dimethylurea, Neostigmine Impurity 24, Neostigmine Impurity 26, m-hydroxyphenyl N,N-dimethylurea
| Molecular Formula | C9H12N2O2 |
|---|---|
| Molecular Weight | 180.09 g/mol |
| LogP | 0.5 |
| Topological Polar Surface Area | 52.6 Ų |
| Hydrogen Bond Donors | 2 |
| Hydrogen Bond Acceptors | 2 |
| Rotatable Bonds | 1 |
| Exact Mass | 180.08987 |
| Heavy Atoms | 13 |
| Complexity | 182.0 |
Chemical Identifiers
| CAS Number | 4849-46-1 |
|---|---|
| SMILES | CN(C)C(=O)NC1=CC(=CC=C1)O |
| InChIKey | HQSQPMWCWCOTBH-UHFFFAOYSA-N |
Patent-Derived Application Labels
Derived from 6 IPC patent classification(s) across the SureChEMBL global patent database.
Product Overview
3-(3-Hydroxyphenyl)-1,1-dimethylurea (CAS 4849-46-1), with molecular formula C9H12N2O2 and molecular weight 180.09 g/mol. IUPAC: 3-(3-hydroxyphenyl)-1,1-dimethylurea.
Chemical Property Profile of 3-(3-Hydroxyphenyl)-1,1-dimethylurea
Property Insights of 3-(3-Hydroxyphenyl)-1,1-dimethylurea
The XLogP value of 0.5 suggests moderate lipophilicity, balancing water solubility and membrane permeability for 3-(3-Hydroxyphenyl)-1,1-dimethylurea. With a topological polar surface area (TPSA) of 52.6 Ų, 3-(3-Hydroxyphenyl)-1,1-dimethylurea exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, 3-(3-Hydroxyphenyl)-1,1-dimethylurea has 2 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 3-(3-Hydroxyphenyl)-1,1-dimethylurea?
The CAS number of 3-(3-Hydroxyphenyl)-1,1-dimethylurea is 4849-46-1.
What is the molecular formula of 3-(3-Hydroxyphenyl)-1,1-dimethylurea?
The molecular formula of 3-(3-Hydroxyphenyl)-1,1-dimethylurea is C9H12N2O2.
What is the molecular weight of 3-(3-Hydroxyphenyl)-1,1-dimethylurea?
The molecular weight of 3-(3-Hydroxyphenyl)-1,1-dimethylurea is 180.09 g/mol.
Where can I buy 3-(3-Hydroxyphenyl)-1,1-dimethylurea?
You can request a quote for 3-(3-Hydroxyphenyl)-1,1-dimethylurea directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 3-(3-Hydroxyphenyl)-1,1-dimethylurea?
Yes, KEHONG BIO provides custom synthesis services for 3-(3-Hydroxyphenyl)-1,1-dimethylurea and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.