N-Nitroso-N-pentyl-(4-hydroxybutyl)amine
TL;DR: N-Nitroso-N-pentyl-(4-hydroxybutyl)amine (CAS 61734-86-9) is a chemical compound with molecular formula C9H20N2O2 and molecular weight 188.15 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
N-(4-hydroxybutyl)-N-pentylnitrous amide
Also Known As: N-Amyl-N-(4-hydroxybutyl)nitrosamine, 4- -1-BUTANOL, 4-(Pentylnitrosoamino)-1-butanol, 4-Amyl-N-(4-hydroxybutyl)nitrosamine, N-Nitroso-N-pentyl-(4-hydroxybutyl)amine
| Molecular Formula | C9H20N2O2 |
|---|---|
| Molecular Weight | 188.15 g/mol |
| LogP | 2.0 |
| Topological Polar Surface Area | 52.9 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 4 |
| Rotatable Bonds | 8 |
| Exact Mass | 188.15248 |
| Heavy Atoms | 13 |
| Complexity | 120.0 |
Chemical Identifiers
| CAS Number | 61734-86-9 |
|---|---|
| SMILES | CCCCCN(CCCCO)N=O |
| InChIKey | LPHYEAYFPYUSAX-UHFFFAOYSA-N |
Product Overview
N-Nitroso-N-pentyl-(4-hydroxybutyl)amine (CAS 61734-86-9), with molecular formula C9H20N2O2 and molecular weight 188.15 g/mol. IUPAC: N-(4-hydroxybutyl)-N-pentylnitrous amide.
Chemical Property Profile of N-Nitroso-N-pentyl-(4-hydroxybutyl)amine
Property Insights of N-Nitroso-N-pentyl-(4-hydroxybutyl)amine
The XLogP value of 2.0 suggests moderate lipophilicity, balancing water solubility and membrane permeability for N-Nitroso-N-pentyl-(4-hydroxybutyl)amine. With a topological polar surface area (TPSA) of 52.9 Ų, N-Nitroso-N-pentyl-(4-hydroxybutyl)amine exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, N-Nitroso-N-pentyl-(4-hydroxybutyl)amine 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 N-Nitroso-N-pentyl-(4-hydroxybutyl)amine?
The CAS number of N-Nitroso-N-pentyl-(4-hydroxybutyl)amine is 61734-86-9.
What is the molecular formula of N-Nitroso-N-pentyl-(4-hydroxybutyl)amine?
The molecular formula of N-Nitroso-N-pentyl-(4-hydroxybutyl)amine is C9H20N2O2.
What is the molecular weight of N-Nitroso-N-pentyl-(4-hydroxybutyl)amine?
The molecular weight of N-Nitroso-N-pentyl-(4-hydroxybutyl)amine is 188.15 g/mol.
Where can I buy N-Nitroso-N-pentyl-(4-hydroxybutyl)amine?
You can request a quote for N-Nitroso-N-pentyl-(4-hydroxybutyl)amine directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for N-Nitroso-N-pentyl-(4-hydroxybutyl)amine?
Yes, KEHONG BIO provides custom synthesis services for N-Nitroso-N-pentyl-(4-hydroxybutyl)amine and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.