1,3-Benzenedimethanimine
TL;DR: 1,3-Benzenedimethanimine (CAS 7235-69-0) is a chemical compound with molecular formula C8H8N2 and molecular weight 132.07 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
(3-methanimidoylphenyl)methanimine
Also Known As: 1,3-Benzenedimethanimine, (1,3-Phenylene)dimethanimine
| Molecular Formula | C8H8N2 |
|---|---|
| Molecular Weight | 132.07 g/mol |
| LogP | 1.0 |
| Topological Polar Surface Area | 47.7 Ų |
| Hydrogen Bond Donors | 2 |
| Hydrogen Bond Acceptors | 2 |
| Rotatable Bonds | 2 |
| Exact Mass | 132.06874 |
| Heavy Atoms | 10 |
| Complexity | 117.0 |
Chemical Identifiers
| CAS Number | 7235-69-0 |
|---|---|
| SMILES | C1=CC(=CC(=C1)C=N)C=N |
| InChIKey | XCCUIQKZNVBRLD-UHFFFAOYSA-N |
Product Overview
1,3-Benzenedimethanimine (CAS 7235-69-0), with molecular formula C8H8N2 and molecular weight 132.07 g/mol. IUPAC: (3-methanimidoylphenyl)methanimine.
Chemical Property Profile of 1,3-Benzenedimethanimine
Property Insights of 1,3-Benzenedimethanimine
The XLogP value of 1.0 suggests moderate lipophilicity, balancing water solubility and membrane permeability for 1,3-Benzenedimethanimine. With a topological polar surface area (TPSA) of 47.7 Ų, 1,3-Benzenedimethanimine exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, 1,3-Benzenedimethanimine 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 1,3-Benzenedimethanimine?
The CAS number of 1,3-Benzenedimethanimine is 7235-69-0.
What is the molecular formula of 1,3-Benzenedimethanimine?
The molecular formula of 1,3-Benzenedimethanimine is C8H8N2.
What is the molecular weight of 1,3-Benzenedimethanimine?
The molecular weight of 1,3-Benzenedimethanimine is 132.07 g/mol.
Where can I buy 1,3-Benzenedimethanimine?
You can request a quote for 1,3-Benzenedimethanimine directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 1,3-Benzenedimethanimine?
Yes, KEHONG BIO provides custom synthesis services for 1,3-Benzenedimethanimine and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.