4-甲基-N-乙氨基苯酚硫酸盐
TL;DR: 4-甲基-N-乙氨基苯酚硫酸盐 (CAS 71005-37-3) is a chemical compound with molecular formula C9H15NO5S and molecular weight 249.07 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
4-甲基-N-乙氨基苯酚硫酸盐
3-(ethylamino)-4-methylphenol;sulfuric acid
Also Known As: 4-Methyl-N-ethylamino phenol sulfate, 3-(Ethylamino)-4-methylphenol sulfate (salt), 3-(ethylamino)-4-methylphenol; sulfuric acid, 3-(ethylamino)-4-methylphenol sulfate (1:1), Phenol, 3-(ethylamino)-4-methyl-, sulfate (salt)
| Molecular Formula | C9H15NO5S |
|---|---|
| Molecular Weight | 249.07 g/mol |
| LogP | 1.47962 |
| Topological Polar Surface Area | 115.0 Ų |
| Hydrogen Bond Donors | 4 |
| Hydrogen Bond Acceptors | 6 |
| Rotatable Bonds | 2 |
| Exact Mass | 249.0671 |
| Heavy Atoms | 16 |
| Complexity | 197.0 |
Chemical Identifiers
| CAS Number | 71005-37-3 |
|---|---|
| SMILES | CCNC1=C(C=CC(=C1)O)C.OS(=O)(=O)O |
| InChIKey | GSQNLXNSIUYREL-UHFFFAOYSA-N |
Product Overview
4-甲基-N-乙氨基苯酚硫酸盐 (CAS 71005-37-3), with molecular formula C9H15NO5S and molecular weight 249.07 g/mol. IUPAC: 3-(ethylamino)-4-methylphenol;sulfuric acid.
Chemical Property Profile of 4-甲基-N-乙氨基苯酚硫酸盐
Property Insights of 4-甲基-N-乙氨基苯酚硫酸盐
The XLogP value of 1.47962 suggests moderate lipophilicity, balancing water solubility and membrane permeability for 4-甲基-N-乙氨基苯酚硫酸盐. The TPSA of 115.0 Ų falls within the moderate polarity range, balancing permeability and solubility for 4-甲基-N-乙氨基苯酚硫酸盐. Following Lipinski's Rule of Five, 4-甲基-N-乙氨基苯酚硫酸盐 has 4 hydrogen bond donor(s) and 6 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-甲基-N-乙氨基苯酚硫酸盐?
The CAS number of 4-甲基-N-乙氨基苯酚硫酸盐 is 71005-37-3.
What is the molecular formula of 4-甲基-N-乙氨基苯酚硫酸盐?
The molecular formula of 4-甲基-N-乙氨基苯酚硫酸盐 is C9H15NO5S.
What is the molecular weight of 4-甲基-N-乙氨基苯酚硫酸盐?
The molecular weight of 4-甲基-N-乙氨基苯酚硫酸盐 is 249.07 g/mol.
Where can I buy 4-甲基-N-乙氨基苯酚硫酸盐?
You can request a quote for 4-甲基-N-乙氨基苯酚硫酸盐 directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 4-甲基-N-乙氨基苯酚硫酸盐?
Yes, KEHONG BIO provides custom synthesis services for 4-甲基-N-乙氨基苯酚硫酸盐 and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.