N,N-Bis(4-hydroxybutyl)nitrosamine
TL;DR: N,N-Bis(4-hydroxybutyl)nitrosamine (CAS 25413-74-5) is a chemical compound with molecular formula C8H18N2O3 and molecular weight 190.13 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
N,N-bis(4-hydroxybutyl)nitrous amide
Also Known As: N,N-Bis(4-hydroxybutyl)nitrosamine, N,N-Di(4-hydroxybutyl)nitrosamine, 1-Butanol, 4,4'-(nitrosimino)bis-, 1-BUTANOL, 4,4'-NITROSIMINODI-, Butanoic acid, 2-ethylhexyl ester
| Molecular Formula | C8H18N2O3 |
|---|---|
| Molecular Weight | 190.13 g/mol |
| LogP | 0.2 |
| Topological Polar Surface Area | 73.1 Ų |
| Hydrogen Bond Donors | 2 |
| Hydrogen Bond Acceptors | 5 |
| Rotatable Bonds | 8 |
| Exact Mass | 190.13174 |
| Heavy Atoms | 13 |
| Complexity | 112.0 |
Chemical Identifiers
| CAS Number | 25413-74-5 |
|---|---|
| SMILES | C(CCO)CN(CCCCO)N=O |
| InChIKey | RPPBLDOPYFQRQU-UHFFFAOYSA-N |
Product Overview
N,N-Bis(4-hydroxybutyl)nitrosamine (CAS 25413-74-5), with molecular formula C8H18N2O3 and molecular weight 190.13 g/mol. IUPAC: N,N-bis(4-hydroxybutyl)nitrous amide.
Chemical Property Profile of N,N-Bis(4-hydroxybutyl)nitrosamine
Property Insights of N,N-Bis(4-hydroxybutyl)nitrosamine
The XLogP value of 0.2 suggests moderate lipophilicity, balancing water solubility and membrane permeability for N,N-Bis(4-hydroxybutyl)nitrosamine. The TPSA of 73.1 Ų falls within the moderate polarity range, balancing permeability and solubility for N,N-Bis(4-hydroxybutyl)nitrosamine. Following Lipinski's Rule of Five, N,N-Bis(4-hydroxybutyl)nitrosamine has 2 hydrogen bond donor(s) and 5 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,N-Bis(4-hydroxybutyl)nitrosamine?
The CAS number of N,N-Bis(4-hydroxybutyl)nitrosamine is 25413-74-5.
What is the molecular formula of N,N-Bis(4-hydroxybutyl)nitrosamine?
The molecular formula of N,N-Bis(4-hydroxybutyl)nitrosamine is C8H18N2O3.
What is the molecular weight of N,N-Bis(4-hydroxybutyl)nitrosamine?
The molecular weight of N,N-Bis(4-hydroxybutyl)nitrosamine is 190.13 g/mol.
Where can I buy N,N-Bis(4-hydroxybutyl)nitrosamine?
You can request a quote for N,N-Bis(4-hydroxybutyl)nitrosamine directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for N,N-Bis(4-hydroxybutyl)nitrosamine?
Yes, KEHONG BIO provides custom synthesis services for N,N-Bis(4-hydroxybutyl)nitrosamine and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.