Propanenitrile, 3-(methyl(4-nitrosophenyl)amino)-, hydrochloride (1:1)
TL;DR: Propanenitrile, 3-(methyl(4-nitrosophenyl)amino)-, hydrochloride (1:1) (CAS 75522-88-2) is a chemical compound with molecular formula C10H12ClN3O and molecular weight 225.07 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
3-(N-methyl-4-nitrosoanilino)propanenitrile;hydrochloride
Also Known As: N-(2-Cyanoethyl)-N-methyl-p-nitrosoaniline hydrochloride, N-(2-Cyanoethyl)-N-methyl-p-nitrosoaniline, hydrochloride, Propanenitrile, 3-(methyl(4-nitrosophenyl)amino)-, monohydrochloride, Propanenitrile, 3-(methyl(4-nitrosophenyl)amino)-, hydrochloride (1:1), 3-(N-methyl-4-nitrosoanilino)propanenitrile hydrochloride
| Molecular Formula | C10H12ClN3O |
|---|---|
| Molecular Weight | 225.07 g/mol |
| LogP | 2.85618 |
| Topological Polar Surface Area | 56.46 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 4 |
| Rotatable Bonds | 4 |
| Exact Mass | 225.0669 |
| Heavy Atoms | 15 |
| Complexity | 344.6803 |
Chemical Identifiers
| CAS Number | 75522-88-2 |
|---|---|
| SMILES | CN(CCC#N)C1=CC=C(C=C1)N=O.Cl |
Product Overview
Propanenitrile, 3-(methyl(4-nitrosophenyl)amino)-, hydrochloride (1:1) (CAS 75522-88-2), with molecular formula C10H12ClN3O and molecular weight 225.07 g/mol. IUPAC: 3-(N-methyl-4-nitrosoanilino)propanenitrile;hydrochloride.
Chemical Property Profile of Propanenitrile, 3-(methyl(4-nitrosophenyl)amino)-, hydrochloride (1:1)
Property Insights of Propanenitrile, 3-(methyl(4-nitrosophenyl)amino)-, hydrochloride (1:1)
The XLogP value of 2.85618 suggests moderate lipophilicity, balancing water solubility and membrane permeability for Propanenitrile, 3-(methyl(4-nitrosophenyl)amino)-, hydrochloride (1:1). With a topological polar surface area (TPSA) of 56.46 Ų, Propanenitrile, 3-(methyl(4-nitrosophenyl)amino)-, hydrochloride (1:1) exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, Propanenitrile, 3-(methyl(4-nitrosophenyl)amino)-, hydrochloride (1:1) has 0 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 Propanenitrile, 3-(methyl(4-nitrosophenyl)amino)-, hydrochloride (1:1)?
The CAS number of Propanenitrile, 3-(methyl(4-nitrosophenyl)amino)-, hydrochloride (1:1) is 75522-88-2.
What is the molecular formula of Propanenitrile, 3-(methyl(4-nitrosophenyl)amino)-, hydrochloride (1:1)?
The molecular formula of Propanenitrile, 3-(methyl(4-nitrosophenyl)amino)-, hydrochloride (1:1) is C10H12ClN3O.
What is the molecular weight of Propanenitrile, 3-(methyl(4-nitrosophenyl)amino)-, hydrochloride (1:1)?
The molecular weight of Propanenitrile, 3-(methyl(4-nitrosophenyl)amino)-, hydrochloride (1:1) is 225.07 g/mol.
Where can I buy Propanenitrile, 3-(methyl(4-nitrosophenyl)amino)-, hydrochloride (1:1)?
You can request a quote for Propanenitrile, 3-(methyl(4-nitrosophenyl)amino)-, hydrochloride (1:1) directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for Propanenitrile, 3-(methyl(4-nitrosophenyl)amino)-, hydrochloride (1:1)?
Yes, KEHONG BIO provides custom synthesis services for Propanenitrile, 3-(methyl(4-nitrosophenyl)amino)-, hydrochloride (1:1) and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.