3-(1H-imidazol-4-yl)propan-1-ol
TL;DR: 3-(1H-imidazol-4-yl)propan-1-ol (CAS 49549-75-9) is a chemical compound with molecular formula C6H10N2O and molecular weight 126.08 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
3-(1H-imidazol-5-yl)propan-1-ol
Also Known As: 3-(1H-imidazol-5-yl)propan-1-ol, 1H-Imidazole-5-propanol, 3-(1H-Imidazol-4-yl)-1-propanol, 1H-Imidazole-4-propanol, 3-(1H-IMIDAZOL-4-YL)PROPAN-1-OL
| Molecular Formula | C6H10N2O |
|---|---|
| Molecular Weight | 126.08 g/mol |
| LogP | -0.1 |
| Topological Polar Surface Area | 48.9 Ų |
| Hydrogen Bond Donors | 2 |
| Hydrogen Bond Acceptors | 2 |
| Rotatable Bonds | 3 |
| Exact Mass | 126.079315 |
| Heavy Atoms | 9 |
| Complexity | 77.0 |
Chemical Identifiers
| CAS Number | 49549-75-9 |
|---|---|
| SMILES | C1=C(NC=N1)CCCO |
| InChIKey | DKFVEDKCRIZEEM-UHFFFAOYSA-N |
Patent-Derived Application Labels
Derived from 6 IPC patent classification(s) across the SureChEMBL global patent database.
Product Overview
3-(1H-imidazol-4-yl)propan-1-ol (CAS 49549-75-9), with molecular formula C6H10N2O and molecular weight 126.08 g/mol. IUPAC: 3-(1H-imidazol-5-yl)propan-1-ol.
Chemical Property Profile of 3-(1H-imidazol-4-yl)propan-1-ol
Property Insights of 3-(1H-imidazol-4-yl)propan-1-ol
The XLogP value of -0.1 indicates that 3-(1H-imidazol-4-yl)propan-1-ol is hydrophilic (water-soluble), making it suitable for aqueous formulations and biological assay applications. With a topological polar surface area (TPSA) of 48.9 Ų, 3-(1H-imidazol-4-yl)propan-1-ol exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, 3-(1H-imidazol-4-yl)propan-1-ol 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-(1H-imidazol-4-yl)propan-1-ol?
The CAS number of 3-(1H-imidazol-4-yl)propan-1-ol is 49549-75-9.
What is the molecular formula of 3-(1H-imidazol-4-yl)propan-1-ol?
The molecular formula of 3-(1H-imidazol-4-yl)propan-1-ol is C6H10N2O.
What is the molecular weight of 3-(1H-imidazol-4-yl)propan-1-ol?
The molecular weight of 3-(1H-imidazol-4-yl)propan-1-ol is 126.08 g/mol.
Where can I buy 3-(1H-imidazol-4-yl)propan-1-ol?
You can request a quote for 3-(1H-imidazol-4-yl)propan-1-ol directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 3-(1H-imidazol-4-yl)propan-1-ol?
Yes, KEHONG BIO provides custom synthesis services for 3-(1H-imidazol-4-yl)propan-1-ol and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.