N-butyl-N-(3-carboxypropyl)nitrosamine
TL;DR: N-butyl-N-(3-carboxypropyl)nitrosamine (CAS 38252-74-3) is a chemical compound with molecular formula C8H16N2O3 and molecular weight 188.12 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
4-[butyl(nitroso)amino]butanoic acid
Also Known As: BCPN, Butyl(3-carboxypropyl)nitrosamine, 4-(N-Butyl-N-nitrosamino)butyric Acid, 4-[butyl(nitroso)amino]butanoic acid, 4-(Butylnitrosoamino)butanoic acid
| Molecular Formula | C8H16N2O3 |
|---|---|
| Molecular Weight | 188.12 g/mol |
| LogP | 1.2 |
| Topological Polar Surface Area | 70.0 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 5 |
| Rotatable Bonds | 7 |
| Exact Mass | 188.11609 |
| Heavy Atoms | 13 |
| Complexity | 161.0 |
Chemical Identifiers
| CAS Number | 38252-74-3 |
|---|---|
| SMILES | CCCCN(CCCC(=O)O)N=O |
| InChIKey | OAAQPYUFAOHUMT-UHFFFAOYSA-N |
Patent-Derived Application Labels
Derived from 2 IPC patent classification(s) across the SureChEMBL global patent database.
Product Overview
N-butyl-N-(3-carboxypropyl)nitrosamine (CAS 38252-74-3), with molecular formula C8H16N2O3 and molecular weight 188.12 g/mol. IUPAC: 4-[butyl(nitroso)amino]butanoic acid.
Chemical Property Profile of N-butyl-N-(3-carboxypropyl)nitrosamine
Property Insights of N-butyl-N-(3-carboxypropyl)nitrosamine
The XLogP value of 1.2 suggests moderate lipophilicity, balancing water solubility and membrane permeability for N-butyl-N-(3-carboxypropyl)nitrosamine. The TPSA of 70.0 Ų falls within the moderate polarity range, balancing permeability and solubility for N-butyl-N-(3-carboxypropyl)nitrosamine. Following Lipinski's Rule of Five, N-butyl-N-(3-carboxypropyl)nitrosamine has 1 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-butyl-N-(3-carboxypropyl)nitrosamine?
The CAS number of N-butyl-N-(3-carboxypropyl)nitrosamine is 38252-74-3.
What is the molecular formula of N-butyl-N-(3-carboxypropyl)nitrosamine?
The molecular formula of N-butyl-N-(3-carboxypropyl)nitrosamine is C8H16N2O3.
What is the molecular weight of N-butyl-N-(3-carboxypropyl)nitrosamine?
The molecular weight of N-butyl-N-(3-carboxypropyl)nitrosamine is 188.12 g/mol.
Where can I buy N-butyl-N-(3-carboxypropyl)nitrosamine?
You can request a quote for N-butyl-N-(3-carboxypropyl)nitrosamine directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for N-butyl-N-(3-carboxypropyl)nitrosamine?
Yes, KEHONG BIO provides custom synthesis services for N-butyl-N-(3-carboxypropyl)nitrosamine and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.