Benzene-1,3-diamine;formaldehyde;sulfane
TL;DR: Benzene-1,3-diamine;formaldehyde;sulfane (CAS 70892-33-0) is a chemical compound with molecular formula C7H12N2OS and molecular weight 172.07 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
benzene-1,3-diamine;formaldehyde;sulfane
Also Known As: benzene-1,3-diamine; formaldehyde; sulfane, 1,3-Benzenediamine, formaldehyde, sulfur reaction product, Formaldehyde, reaction products with m-phenylenediamine and sulfur
| Molecular Formula | C7H12N2OS |
|---|---|
| Molecular Weight | 172.07 g/mol |
| LogP | 0.7789 |
| Topological Polar Surface Area | 70.1 Ų |
| Hydrogen Bond Donors | 3 |
| Hydrogen Bond Acceptors | 4 |
| Rotatable Bonds | 0 |
| Exact Mass | 172.06703 |
| Heavy Atoms | 11 |
| Complexity | 66.0 |
Chemical Identifiers
| CAS Number | 70892-33-0 |
|---|---|
| SMILES | C=O.C1=CC(=CC(=C1)N)N.S |
| InChIKey | SMYRGQBXUQSCBQ-UHFFFAOYSA-N |
Product Overview
Benzene-1,3-diamine;formaldehyde;sulfane (CAS 70892-33-0), with molecular formula C7H12N2OS and molecular weight 172.07 g/mol. IUPAC: benzene-1,3-diamine;formaldehyde;sulfane.
Chemical Property Profile of Benzene-1,3-diamine;formaldehyde;sulfane
Property Insights of Benzene-1,3-diamine;formaldehyde;sulfane
The XLogP value of 0.7789 suggests moderate lipophilicity, balancing water solubility and membrane permeability for Benzene-1,3-diamine;formaldehyde;sulfane. The TPSA of 70.1 Ų falls within the moderate polarity range, balancing permeability and solubility for Benzene-1,3-diamine;formaldehyde;sulfane. Following Lipinski's Rule of Five, Benzene-1,3-diamine;formaldehyde;sulfane has 3 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 Benzene-1,3-diamine;formaldehyde;sulfane?
The CAS number of Benzene-1,3-diamine;formaldehyde;sulfane is 70892-33-0.
What is the molecular formula of Benzene-1,3-diamine;formaldehyde;sulfane?
The molecular formula of Benzene-1,3-diamine;formaldehyde;sulfane is C7H12N2OS.
What is the molecular weight of Benzene-1,3-diamine;formaldehyde;sulfane?
The molecular weight of Benzene-1,3-diamine;formaldehyde;sulfane is 172.07 g/mol.
Where can I buy Benzene-1,3-diamine;formaldehyde;sulfane?
You can request a quote for Benzene-1,3-diamine;formaldehyde;sulfane directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for Benzene-1,3-diamine;formaldehyde;sulfane?
Yes, KEHONG BIO provides custom synthesis services for Benzene-1,3-diamine;formaldehyde;sulfane and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.