Benzenemethanamine, N-butyl-N-nitroso-
TL;DR: Benzenemethanamine, N-butyl-N-nitroso- (CAS 40055-48-9) is a chemical compound with molecular formula C11H16N2O and molecular weight 192.13 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
N-benzyl-N-butylnitrous amide
Also Known As: benzyl(butyl)nitrosoamine, N-Butyl-N-nitrosobenzylamine, N-benzyl-N-butylnitrous amide, N-Butyl-N-nitrosobenzenemethanamine, Benzenemethanamine, N-butyl-N-nitroso-
| Molecular Formula | C11H16N2O |
|---|---|
| Molecular Weight | 192.13 g/mol |
| LogP | 2.9 |
| Topological Polar Surface Area | 32.7 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 3 |
| Rotatable Bonds | 5 |
| Exact Mass | 192.12627 |
| Heavy Atoms | 14 |
| Complexity | 155.0 |
Chemical Identifiers
| CAS Number | 40055-48-9 |
|---|---|
| SMILES | CCCCN(CC1=CC=CC=C1)N=O |
| InChIKey | PZWXWCLLAAJOBK-UHFFFAOYSA-N |
Patent-Derived Application Labels
Derived from 1 IPC patent classification(s) across the SureChEMBL global patent database.
Product Overview
Benzenemethanamine, N-butyl-N-nitroso- (CAS 40055-48-9), with molecular formula C11H16N2O and molecular weight 192.13 g/mol. IUPAC: N-benzyl-N-butylnitrous amide.
Chemical Property Profile of Benzenemethanamine, N-butyl-N-nitroso-
Property Insights of Benzenemethanamine, N-butyl-N-nitroso-
The XLogP value of 2.9 suggests moderate lipophilicity, balancing water solubility and membrane permeability for Benzenemethanamine, N-butyl-N-nitroso-. With a topological polar surface area (TPSA) of 32.7 Ų, Benzenemethanamine, N-butyl-N-nitroso- exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, Benzenemethanamine, N-butyl-N-nitroso- has 0 hydrogen bond donor(s) and 3 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 Benzenemethanamine, N-butyl-N-nitroso-?
The CAS number of Benzenemethanamine, N-butyl-N-nitroso- is 40055-48-9.
What is the molecular formula of Benzenemethanamine, N-butyl-N-nitroso-?
The molecular formula of Benzenemethanamine, N-butyl-N-nitroso- is C11H16N2O.
What is the molecular weight of Benzenemethanamine, N-butyl-N-nitroso-?
The molecular weight of Benzenemethanamine, N-butyl-N-nitroso- is 192.13 g/mol.
Where can I buy Benzenemethanamine, N-butyl-N-nitroso-?
You can request a quote for Benzenemethanamine, N-butyl-N-nitroso- directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for Benzenemethanamine, N-butyl-N-nitroso-?
Yes, KEHONG BIO provides custom synthesis services for Benzenemethanamine, N-butyl-N-nitroso- and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.