N1,N3-Dimethylbenzene-1,3-diamine
TL;DR: N1,N3-Dimethylbenzene-1,3-diamine (CAS 14814-75-6) is a chemical compound with molecular formula C8H12N2 and molecular weight 136.10 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
1-N,3-N-dimethylbenzene-1,3-diamine
Also Known As: N1,N3-Dimethylbenzene-1,3-diamine, N,N'-Dimethylbenzene-1,3-diamine, N1,N3-Dimethyl-1,3-benzenediamine, 1-N,3-N-dimethylbenzene-1,3-diamine, N,N'-Dimethyl-1,3-benzenediamine
| Molecular Formula | C8H12N2 |
|---|---|
| Molecular Weight | 136.10 g/mol |
| LogP | 1.6 |
| Topological Polar Surface Area | 24.1 Ų |
| Hydrogen Bond Donors | 2 |
| Hydrogen Bond Acceptors | 2 |
| Rotatable Bonds | 2 |
| Exact Mass | 136.10005 |
| Heavy Atoms | 10 |
| Complexity | 83.0 |
Chemical Identifiers
| CAS Number | 14814-75-6 |
|---|---|
| SMILES | CNC1=CC(=CC=C1)NC |
| InChIKey | UQBNGMRDYGPUOO-UHFFFAOYSA-N |
Patent-Derived Application Labels
Derived from 9 IPC patent classification(s) across the SureChEMBL global patent database.
Product Overview
N1,N3-Dimethylbenzene-1,3-diamine (CAS 14814-75-6), with molecular formula C8H12N2 and molecular weight 136.10 g/mol. IUPAC: 1-N,3-N-dimethylbenzene-1,3-diamine.
Chemical Property Profile of N1,N3-Dimethylbenzene-1,3-diamine
Property Insights of N1,N3-Dimethylbenzene-1,3-diamine
The XLogP value of 1.6 suggests moderate lipophilicity, balancing water solubility and membrane permeability for N1,N3-Dimethylbenzene-1,3-diamine. With a topological polar surface area (TPSA) of 24.1 Ų, N1,N3-Dimethylbenzene-1,3-diamine exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, N1,N3-Dimethylbenzene-1,3-diamine has 2 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 N1,N3-Dimethylbenzene-1,3-diamine?
The CAS number of N1,N3-Dimethylbenzene-1,3-diamine is 14814-75-6.
What is the molecular formula of N1,N3-Dimethylbenzene-1,3-diamine?
The molecular formula of N1,N3-Dimethylbenzene-1,3-diamine is C8H12N2.
What is the molecular weight of N1,N3-Dimethylbenzene-1,3-diamine?
The molecular weight of N1,N3-Dimethylbenzene-1,3-diamine is 136.10 g/mol.
Where can I buy N1,N3-Dimethylbenzene-1,3-diamine?
You can request a quote for N1,N3-Dimethylbenzene-1,3-diamine directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for N1,N3-Dimethylbenzene-1,3-diamine?
Yes, KEHONG BIO provides custom synthesis services for N1,N3-Dimethylbenzene-1,3-diamine and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.