1-Hydroxy-2-isopropylguanidine
TL;DR: 1-Hydroxy-2-isopropylguanidine (CAS 478806-77-8) is a chemical compound with molecular formula C4H11N3O and molecular weight 117.09 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
1-hydroxy-2-propan-2-ylguanidine
Also Known As: N-ISOPROPYL-N'-HYDROXYGUANIDINE, 1-hydroxy-2-propan-2-ylguanidine, 1-hydroxy-3-isopropylguanidine, 1-hydroxy-2-isopropylguanidine, N-HYDROXY-N'-ISOPROPYLGUANIDIE
| Molecular Formula | C4H11N3O |
|---|---|
| Molecular Weight | 117.09 g/mol |
| LogP | -0.6 |
| Topological Polar Surface Area | 70.6 Ų |
| Hydrogen Bond Donors | 3 |
| Hydrogen Bond Acceptors | 2 |
| Rotatable Bonds | 2 |
| Exact Mass | 117.09021 |
| Heavy Atoms | 8 |
| Complexity | 89.0 |
Chemical Identifiers
| CAS Number | 478806-77-8 |
|---|---|
| SMILES | CC(C)N=C(N)NO |
| InChIKey | OITVEDMMUMUWTL-UHFFFAOYSA-N |
Patent-Derived Application Labels
Derived from 2 IPC patent classification(s) across the SureChEMBL global patent database.
Product Overview
1-Hydroxy-2-isopropylguanidine (CAS 478806-77-8), with molecular formula C4H11N3O and molecular weight 117.09 g/mol. IUPAC: 1-hydroxy-2-propan-2-ylguanidine.
Chemical Property Profile of 1-Hydroxy-2-isopropylguanidine
Property Insights of 1-Hydroxy-2-isopropylguanidine
The XLogP value of -0.6 indicates that 1-Hydroxy-2-isopropylguanidine is hydrophilic (water-soluble), making it suitable for aqueous formulations and biological assay applications. The TPSA of 70.6 Ų falls within the moderate polarity range, balancing permeability and solubility for 1-Hydroxy-2-isopropylguanidine. Following Lipinski's Rule of Five, 1-Hydroxy-2-isopropylguanidine has 3 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-Hydroxy-2-isopropylguanidine?
The CAS number of 1-Hydroxy-2-isopropylguanidine is 478806-77-8.
What is the molecular formula of 1-Hydroxy-2-isopropylguanidine?
The molecular formula of 1-Hydroxy-2-isopropylguanidine is C4H11N3O.
What is the molecular weight of 1-Hydroxy-2-isopropylguanidine?
The molecular weight of 1-Hydroxy-2-isopropylguanidine is 117.09 g/mol.
Where can I buy 1-Hydroxy-2-isopropylguanidine?
You can request a quote for 1-Hydroxy-2-isopropylguanidine directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 1-Hydroxy-2-isopropylguanidine?
Yes, KEHONG BIO provides custom synthesis services for 1-Hydroxy-2-isopropylguanidine and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.