4-甲氧基-1,3-苯二胺硫酸盐(1:1)
TL;DR: 4-甲氧基-1,3-苯二胺硫酸盐(1:1) (CAS 39156-41-7) is a chemical compound with molecular formula C7H12N2O5S and molecular weight 236.05 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
4-甲氧基-1,3-苯二胺硫酸盐(1:1)
4-methoxybenzene-1,3-diamine;sulfuric acid
Also Known As: 2,4-DIAMINOANISOLE SULFATE, 4-Methoxybenzene-1,3-diamine sulfate, Pelagol Grey, Durafur Brown MN, Fouramine BA
| Molecular Formula | C7H12N2O5S |
|---|---|
| Molecular Weight | 236.05 g/mol |
| LogP | 0.21 |
| Topological Polar Surface Area | 144.0 Ų |
| Hydrogen Bond Donors | 4 |
| Hydrogen Bond Acceptors | 7 |
| Rotatable Bonds | 1 |
| Exact Mass | 236.04669 |
| Heavy Atoms | 15 |
| Complexity | 189.0 |
| Melting Point | 372 to 192.2 °C (decomposes) |
| Solubility | 10 to 50 mg/mL at 65.3 °F (NTP, 1992) |
Chemical Identifiers
| CAS Number | 39156-41-7 |
|---|---|
| SMILES | COC1=C(C=C(C=C1)N)N.OS(=O)(=O)O |
| InChIKey | FDJQHYWUHGBBTO-UHFFFAOYSA-N |
Patent-Derived Application Labels
Derived from 7 IPC patent classification(s) across the SureChEMBL global patent database.
Product Overview
4-甲氧基-1,3-苯二胺硫酸盐(1:1) (CAS 39156-41-7), with molecular formula C7H12N2O5S and molecular weight 236.05 g/mol. IUPAC: 4-methoxybenzene-1,3-diamine;sulfuric acid.
Chemical Property Profile of 4-甲氧基-1,3-苯二胺硫酸盐(1:1)
Property Insights of 4-甲氧基-1,3-苯二胺硫酸盐(1:1)
The XLogP value of 0.21 suggests moderate lipophilicity, balancing water solubility and membrane permeability for 4-甲氧基-1,3-苯二胺硫酸盐(1:1). The TPSA of 144.0 Ų indicates high polarity, suggesting 4-甲氧基-1,3-苯二胺硫酸盐(1:1) may have limited membrane permeability but good aqueous solubility. Following Lipinski's Rule of Five, 4-甲氧基-1,3-苯二胺硫酸盐(1:1) has 4 hydrogen bond donor(s) and 7 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-甲氧基-1,3-苯二胺硫酸盐(1:1)?
The CAS number of 4-甲氧基-1,3-苯二胺硫酸盐(1:1) is 39156-41-7.
What is the molecular formula of 4-甲氧基-1,3-苯二胺硫酸盐(1:1)?
The molecular formula of 4-甲氧基-1,3-苯二胺硫酸盐(1:1) is C7H12N2O5S.
What is the molecular weight of 4-甲氧基-1,3-苯二胺硫酸盐(1:1)?
The molecular weight of 4-甲氧基-1,3-苯二胺硫酸盐(1:1) is 236.05 g/mol.
Where can I buy 4-甲氧基-1,3-苯二胺硫酸盐(1:1)?
You can request a quote for 4-甲氧基-1,3-苯二胺硫酸盐(1:1) directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 4-甲氧基-1,3-苯二胺硫酸盐(1:1)?
Yes, KEHONG BIO provides custom synthesis services for 4-甲氧基-1,3-苯二胺硫酸盐(1:1) and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.