3-Phenylthiophene
TL;DR: 3-Phenylthiophene (CAS 2404-87-7) is a chemical compound with molecular formula C10H8S and molecular weight 160.03 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
3-phenylthiophene
Also Known As: 3-Phenylthiophene, Thiophene, 3-phenyl-, 3-thienylbenzene, 3-phenyl-thiophene, 3-(1-Naphthyl)thiophene
| Molecular Formula | C10H8S |
|---|---|
| Molecular Weight | 160.03 g/mol |
| LogP | 3.2 |
| Topological Polar Surface Area | 28.2 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 1 |
| Rotatable Bonds | 1 |
| Exact Mass | 160.03467 |
| Heavy Atoms | 11 |
| Complexity | 116.0 |
Chemical Identifiers
| CAS Number | 2404-87-7 |
|---|---|
| SMILES | C1=CC=C(C=C1)C2=CSC=C2 |
| InChIKey | ZDQZVKVIYAPRON-UHFFFAOYSA-N |
Patent-Derived Application Labels
Derived from 13 IPC patent classification(s) across the SureChEMBL global patent database.
Product Overview
3-Phenylthiophene (CAS 2404-87-7), with molecular formula C10H8S and molecular weight 160.03 g/mol. IUPAC: 3-phenylthiophene.
Chemical Property Profile of 3-Phenylthiophene
Property Insights of 3-Phenylthiophene
The XLogP value of 3.2 indicates that 3-Phenylthiophene is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. With a topological polar surface area (TPSA) of 28.2 Ų, 3-Phenylthiophene exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, 3-Phenylthiophene has 0 hydrogen bond donor(s) and 1 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 3-Phenylthiophene?
The CAS number of 3-Phenylthiophene is 2404-87-7.
What is the molecular formula of 3-Phenylthiophene?
The molecular formula of 3-Phenylthiophene is C10H8S.
What is the molecular weight of 3-Phenylthiophene?
The molecular weight of 3-Phenylthiophene is 160.03 g/mol.
Where can I buy 3-Phenylthiophene?
You can request a quote for 3-Phenylthiophene directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 3-Phenylthiophene?
Yes, KEHONG BIO provides custom synthesis services for 3-Phenylthiophene and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.