3a,9b-Dihydronaphtho[1,2-b]thiophene-2-carbaldehyde
TL;DR: 3a,9b-Dihydronaphtho[1,2-b]thiophene-2-carbaldehyde (CAS 887579-89-7) is a chemical compound with molecular formula C13H10OS and molecular weight 214.05 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
3a,9b-dihydrobenzo[g][1]benzothiole-2-carbaldehyde
Also Known As: 3a,9b-dihydronaphtho[1,2-b]thiophene-2-carbaldehyde, 3a,9b-dihydrobenzo[g][1]benzothiole-2-carbaldehyde, 3a,9b-Dihydronaphtho[1,2-b]thiophene-2-carboxaldehyde, AN-278/13643027, 3a,9b-dihydrobenzo[g]benzo[b]thiophene-2-carbaldehyde
| Molecular Formula | C13H10OS |
|---|---|
| Molecular Weight | 214.05 g/mol |
| LogP | 3.2003 |
| Topological Polar Surface Area | 17.07 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 2 |
| Rotatable Bonds | 1 |
| Exact Mass | 214.04524 |
| Heavy Atoms | 15 |
| Complexity | 473.17923 |
Chemical Identifiers
| CAS Number | 887579-89-7 |
|---|---|
| SMILES | C1=CC=C2C3C(C=CC2=C1)C=C(S3)C=O |
Product Overview
3a,9b-Dihydronaphtho[1,2-b]thiophene-2-carbaldehyde (CAS 887579-89-7), with molecular formula C13H10OS and molecular weight 214.05 g/mol. IUPAC: 3a,9b-dihydrobenzo[g][1]benzothiole-2-carbaldehyde.
Chemical Property Profile of 3a,9b-Dihydronaphtho[1,2-b]thiophene-2-carbaldehyde
Property Insights of 3a,9b-Dihydronaphtho[1,2-b]thiophene-2-carbaldehyde
The XLogP value of 3.2003 indicates that 3a,9b-Dihydronaphtho[1,2-b]thiophene-2-carbaldehyde is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. With a topological polar surface area (TPSA) of 17.07 Ų, 3a,9b-Dihydronaphtho[1,2-b]thiophene-2-carbaldehyde exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, 3a,9b-Dihydronaphtho[1,2-b]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 3a,9b-Dihydronaphtho[1,2-b]thiophene-2-carbaldehyde?
The CAS number of 3a,9b-Dihydronaphtho[1,2-b]thiophene-2-carbaldehyde is 887579-89-7.
What is the molecular formula of 3a,9b-Dihydronaphtho[1,2-b]thiophene-2-carbaldehyde?
The molecular formula of 3a,9b-Dihydronaphtho[1,2-b]thiophene-2-carbaldehyde is C13H10OS.
What is the molecular weight of 3a,9b-Dihydronaphtho[1,2-b]thiophene-2-carbaldehyde?
The molecular weight of 3a,9b-Dihydronaphtho[1,2-b]thiophene-2-carbaldehyde is 214.05 g/mol.
Where can I buy 3a,9b-Dihydronaphtho[1,2-b]thiophene-2-carbaldehyde?
You can request a quote for 3a,9b-Dihydronaphtho[1,2-b]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 3a,9b-Dihydronaphtho[1,2-b]thiophene-2-carbaldehyde?
Yes, KEHONG BIO provides custom synthesis services for 3a,9b-Dihydronaphtho[1,2-b]thiophene-2-carbaldehyde and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.