4-N,4-N-dimethylnaphthalene-1,4-diamine
TL;DR: 4-N,4-N-dimethylnaphthalene-1,4-diamine (CAS 880-94-4) is a chemical compound with molecular formula C12H14N2 and molecular weight 186.12 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
4-N,4-N-dimethylnaphthalene-1,4-diamine
Also Known As: 4-N,4-N-dimethylnaphthalene-1,4-diamine, n,n-dimethylnaphthalene-1,4-diamine, N1,N1-Dimethyl-1,4-naphthalenediamine Hydrochloride, N,N-Dimethyl-1,4-naphthalenediamine, N1,N1-Dimethyl-1,4-naphthalenediamine
| Molecular Formula | C12H14N2 |
|---|---|
| Molecular Weight | 186.12 g/mol |
| LogP | 2.8 |
| Topological Polar Surface Area | 29.3 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 2 |
| Rotatable Bonds | 1 |
| Exact Mass | 186.11569 |
| Heavy Atoms | 14 |
| Complexity | 191.0 |
Chemical Identifiers
| CAS Number | 880-94-4 |
|---|---|
| SMILES | CN(C)C1=CC=C(C2=CC=CC=C21)N |
| InChIKey | HLHYXKMOBCRCRR-UHFFFAOYSA-N |
Patent-Derived Application Labels
Derived from 4 IPC patent classification(s) across the SureChEMBL global patent database.
Product Overview
4-N,4-N-dimethylnaphthalene-1,4-diamine (CAS 880-94-4), with molecular formula C12H14N2 and molecular weight 186.12 g/mol. IUPAC: 4-N,4-N-dimethylnaphthalene-1,4-diamine.
Chemical Property Profile of 4-N,4-N-dimethylnaphthalene-1,4-diamine
Property Insights of 4-N,4-N-dimethylnaphthalene-1,4-diamine
The XLogP value of 2.8 suggests moderate lipophilicity, balancing water solubility and membrane permeability for 4-N,4-N-dimethylnaphthalene-1,4-diamine. With a topological polar surface area (TPSA) of 29.3 Ų, 4-N,4-N-dimethylnaphthalene-1,4-diamine exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, 4-N,4-N-dimethylnaphthalene-1,4-diamine has 1 hydrogen bond donor(s) and 2 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 4-N,4-N-dimethylnaphthalene-1,4-diamine?
The CAS number of 4-N,4-N-dimethylnaphthalene-1,4-diamine is 880-94-4.
What is the molecular formula of 4-N,4-N-dimethylnaphthalene-1,4-diamine?
The molecular formula of 4-N,4-N-dimethylnaphthalene-1,4-diamine is C12H14N2.
What is the molecular weight of 4-N,4-N-dimethylnaphthalene-1,4-diamine?
The molecular weight of 4-N,4-N-dimethylnaphthalene-1,4-diamine is 186.12 g/mol.
Where can I buy 4-N,4-N-dimethylnaphthalene-1,4-diamine?
You can request a quote for 4-N,4-N-dimethylnaphthalene-1,4-diamine directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 4-N,4-N-dimethylnaphthalene-1,4-diamine?
Yes, KEHONG BIO provides custom synthesis services for 4-N,4-N-dimethylnaphthalene-1,4-diamine and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.