Benzenamine, N,N-dimethyl-3-nitro-, hydrobromide (1:1)
TL;DR: Benzenamine, N,N-dimethyl-3-nitro-, hydrobromide (1:1) (CAS 63467-70-9) is a chemical compound with molecular formula C8H11BrN2O2 and molecular weight 246.00 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
N,N-dimethyl-3-nitroaniline;hydrobromide
Also Known As: N,N-Dimethyl-3-nitroanilinium monobromide, Benzenamine, N,N-dimethyl-3-nitro-, monohydrobromide, N,N-dimethyl-3-nitroaniline hydrobromide, Benzenamine, N,N-dimethyl-3-nitro-, hydrobromide (1:1), 2,2,6,6-Tetramethyl-piperidin-4-on-oxim,Hydrochlorid
| Molecular Formula | C8H11BrN2O2 |
|---|---|
| Molecular Weight | 246.00 g/mol |
| LogP | 2.24 |
| Topological Polar Surface Area | 49.1 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 3 |
| Rotatable Bonds | 1 |
| Exact Mass | 246.0004 |
| Heavy Atoms | 13 |
| Complexity | 165.0 |
Chemical Identifiers
| CAS Number | 63467-70-9 |
|---|---|
| SMILES | CN(C)C1=CC(=CC=C1)[N+](=O)[O-].Br |
| InChIKey | IZBUNSGDZIRXPB-UHFFFAOYSA-N |
Product Overview
Benzenamine, N,N-dimethyl-3-nitro-, hydrobromide (1:1) (CAS 63467-70-9), with molecular formula C8H11BrN2O2 and molecular weight 246.00 g/mol. IUPAC: N,N-dimethyl-3-nitroaniline;hydrobromide.
Chemical Property Profile of Benzenamine, N,N-dimethyl-3-nitro-, hydrobromide (1:1)
Property Insights of Benzenamine, N,N-dimethyl-3-nitro-, hydrobromide (1:1)
The XLogP value of 2.24 suggests moderate lipophilicity, balancing water solubility and membrane permeability for Benzenamine, N,N-dimethyl-3-nitro-, hydrobromide (1:1). With a topological polar surface area (TPSA) of 49.1 Ų, Benzenamine, N,N-dimethyl-3-nitro-, hydrobromide (1:1) exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, Benzenamine, N,N-dimethyl-3-nitro-, hydrobromide (1:1) has 1 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 Benzenamine, N,N-dimethyl-3-nitro-, hydrobromide (1:1)?
The CAS number of Benzenamine, N,N-dimethyl-3-nitro-, hydrobromide (1:1) is 63467-70-9.
What is the molecular formula of Benzenamine, N,N-dimethyl-3-nitro-, hydrobromide (1:1)?
The molecular formula of Benzenamine, N,N-dimethyl-3-nitro-, hydrobromide (1:1) is C8H11BrN2O2.
What is the molecular weight of Benzenamine, N,N-dimethyl-3-nitro-, hydrobromide (1:1)?
The molecular weight of Benzenamine, N,N-dimethyl-3-nitro-, hydrobromide (1:1) is 246.00 g/mol.
Where can I buy Benzenamine, N,N-dimethyl-3-nitro-, hydrobromide (1:1)?
You can request a quote for Benzenamine, N,N-dimethyl-3-nitro-, hydrobromide (1:1) directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for Benzenamine, N,N-dimethyl-3-nitro-, hydrobromide (1:1)?
Yes, KEHONG BIO provides custom synthesis services for Benzenamine, N,N-dimethyl-3-nitro-, hydrobromide (1:1) and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.