Dibenzo(b,d)thiophene-2-carbaldehyde
TL;DR: Dibenzo(b,d)thiophene-2-carbaldehyde (CAS 22099-75-8) is a chemical compound with molecular formula C13H8OS and molecular weight 212.03 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
dibenzothiophene-2-carbaldehyde
Also Known As: dibenzo[b,d]thiophene-2-carbaldehyde, Dibenzothiophene-2-carboxaldehyde, dibenzothiophene-2-carbaldehyde, 2-Dibenzothiophenecarboxaldehyde, 2-Dibenzothiophene carboxaldehyde
| Molecular Formula | C13H8OS |
|---|---|
| Molecular Weight | 212.03 g/mol |
| LogP | 3.8 |
| Topological Polar Surface Area | 45.3 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 2 |
| Rotatable Bonds | 1 |
| Exact Mass | 212.02959 |
| Heavy Atoms | 15 |
| Complexity | 253.0 |
Chemical Identifiers
| CAS Number | 22099-75-8 |
|---|---|
| SMILES | C1=CC=C2C(=C1)C3=C(S2)C=CC(=C3)C=O |
| InChIKey | QFGXAEFJJINHAI-UHFFFAOYSA-N |
Patent-Derived Application Labels
Derived from 2 IPC patent classification(s) across the SureChEMBL global patent database.
Product Overview
Dibenzo(b,d)thiophene-2-carbaldehyde (CAS 22099-75-8), with molecular formula C13H8OS and molecular weight 212.03 g/mol. IUPAC: dibenzothiophene-2-carbaldehyde.
Chemical Property Profile of Dibenzo(b,d)thiophene-2-carbaldehyde
Property Insights of Dibenzo(b,d)thiophene-2-carbaldehyde
The XLogP value of 3.8 indicates that Dibenzo(b,d)thiophene-2-carbaldehyde is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. With a topological polar surface area (TPSA) of 45.3 Ų, Dibenzo(b,d)thiophene-2-carbaldehyde exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, Dibenzo(b,d)thiophene-2-carbaldehyde has 0 hydrogen bond donor(s) and 2 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 Dibenzo(b,d)thiophene-2-carbaldehyde?
The CAS number of Dibenzo(b,d)thiophene-2-carbaldehyde is 22099-75-8.
What is the molecular formula of Dibenzo(b,d)thiophene-2-carbaldehyde?
The molecular formula of Dibenzo(b,d)thiophene-2-carbaldehyde is C13H8OS.
What is the molecular weight of Dibenzo(b,d)thiophene-2-carbaldehyde?
The molecular weight of Dibenzo(b,d)thiophene-2-carbaldehyde is 212.03 g/mol.
Where can I buy Dibenzo(b,d)thiophene-2-carbaldehyde?
You can request a quote for Dibenzo(b,d)thiophene-2-carbaldehyde directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for Dibenzo(b,d)thiophene-2-carbaldehyde?
Yes, KEHONG BIO provides custom synthesis services for Dibenzo(b,d)thiophene-2-carbaldehyde and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.