1-Nitrosoazepan-4-ol
TL;DR: 1-Nitrosoazepan-4-ol (CAS 77428-17-2) is a chemical compound with molecular formula C6H12N2O2 and molecular weight 144.09 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
1-nitrosoazepan-4-ol
Also Known As: 1-nitrosoazepan-4-ol, Hexahydro-1-nitroso-1H-azepin-4-ol, gamma-Hydroxy-N-nitrosohexamethyleneimine, Hydroxy-n-nitrosohexamethyleneimine, 1H-AZEPIN-4-OL, HEXAHYDRO-1-NITROSO-
| Molecular Formula | C6H12N2O2 |
|---|---|
| Molecular Weight | 144.09 g/mol |
| LogP | -0.5 |
| Topological Polar Surface Area | 52.9 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 4 |
| Rotatable Bonds | 0 |
| Exact Mass | 144.08987 |
| Heavy Atoms | 10 |
| Complexity | 118.0 |
Chemical Identifiers
| CAS Number | 77428-17-2 |
|---|---|
| SMILES | C1CC(CCN(C1)N=O)O |
| InChIKey | YRLZLSUWKDDOAR-UHFFFAOYSA-N |
Product Overview
1-Nitrosoazepan-4-ol (CAS 77428-17-2), with molecular formula C6H12N2O2 and molecular weight 144.09 g/mol. IUPAC: 1-nitrosoazepan-4-ol.
Chemical Property Profile of 1-Nitrosoazepan-4-ol
Property Insights of 1-Nitrosoazepan-4-ol
The XLogP value of -0.5 indicates that 1-Nitrosoazepan-4-ol is hydrophilic (water-soluble), making it suitable for aqueous formulations and biological assay applications. With a topological polar surface area (TPSA) of 52.9 Ų, 1-Nitrosoazepan-4-ol exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, 1-Nitrosoazepan-4-ol has 1 hydrogen bond donor(s) and 4 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-Nitrosoazepan-4-ol?
The CAS number of 1-Nitrosoazepan-4-ol is 77428-17-2.
What is the molecular formula of 1-Nitrosoazepan-4-ol?
The molecular formula of 1-Nitrosoazepan-4-ol is C6H12N2O2.
What is the molecular weight of 1-Nitrosoazepan-4-ol?
The molecular weight of 1-Nitrosoazepan-4-ol is 144.09 g/mol.
Where can I buy 1-Nitrosoazepan-4-ol?
You can request a quote for 1-Nitrosoazepan-4-ol directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 1-Nitrosoazepan-4-ol?
Yes, KEHONG BIO provides custom synthesis services for 1-Nitrosoazepan-4-ol and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.