睾内酯酮
TL;DR: 睾内酯酮 (CAS 4416-57-3) is a chemical compound with molecular formula C7H5NOS and molecular weight 151.01 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
睾内酯酮
(4-hydroxyphenyl) thiocyanate
Also Known As: p-Thiocyanatophenol, 4-Thiocyanatophenol, 4-HYDROXYPHENYL THIOCYANATE, 4-Thiocyanophenol, p-Thiocyanato-Phenol
| Molecular Formula | C7H5NOS |
|---|---|
| Molecular Weight | 151.01 g/mol |
| LogP | 2.1 |
| Topological Polar Surface Area | 69.3 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 3 |
| Rotatable Bonds | 1 |
| Exact Mass | 151.00919 |
| Heavy Atoms | 10 |
| Complexity | 143.0 |
Chemical Identifiers
| CAS Number | 4416-57-3 |
|---|---|
| SMILES | C1=CC(=CC=C1O)SC#N |
| InChIKey | FMRRFPFZGPDDLZ-UHFFFAOYSA-N |
Patent-Derived Application Labels
Derived from 12 IPC patent classification(s) across the SureChEMBL global patent database.
Product Overview
睾内酯酮 (CAS 4416-57-3), with molecular formula C7H5NOS and molecular weight 151.01 g/mol. IUPAC: (4-hydroxyphenyl) thiocyanate.
Chemical Property Profile of 睾内酯酮
Property Insights of 睾内酯酮
The XLogP value of 2.1 suggests moderate lipophilicity, balancing water solubility and membrane permeability for 睾内酯酮. The TPSA of 69.3 Ų falls within the moderate polarity range, balancing permeability and solubility for 睾内酯酮. Following Lipinski's Rule of Five, 睾内酯酮 has 1 hydrogen bond donor(s) and 3 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 睾内酯酮?
The CAS number of 睾内酯酮 is 4416-57-3.
What is the molecular formula of 睾内酯酮?
The molecular formula of 睾内酯酮 is C7H5NOS.
What is the molecular weight of 睾内酯酮?
The molecular weight of 睾内酯酮 is 151.01 g/mol.
Where can I buy 睾内酯酮?
You can request a quote for 睾内酯酮 directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 睾内酯酮?
Yes, KEHONG BIO provides custom synthesis services for 睾内酯酮 and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.