1,3-Dichloro-dibenzothiophene
TL;DR: 1,3-Dichloro-dibenzothiophene (CAS 153524-14-2) is a chemical compound with molecular formula C12H6Cl2S and molecular weight 251.95673 g/mol, supplied by CoreyChem (Career Henan Chemical Co., Ltd.) with ISO-certified quality and global shipping.
1,3-dichlorodibenzothiophene
Also Known As: 1,3-Dichloro-dibenzothiophene, 1,3-dichlorodibenzothiophene, 1,3-Dichlorodibenzo[b,d]thiophene, J1.080.270I, 3,5-dichloro-8-thiatricyclo[7.4.0.02,7]trideca-1(9),2(7),3,5,10,12-hexaene
Technical Specifications
| Molecular Formula | C12H6Cl2S |
| Molecular Weight | 251.95673 g/mol |
| XLogP | 5.5 |
| Topological Polar Surface Area (TPSA) | 28.2 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 1 |
| Rotatable Bonds | 0 |
| Exact Mass | 251.95673 Da |
| Heavy Atoms | 15 |
| Complexity | 246.0 |
| SMILES | C1=CC=C2C(=C1)C3=C(S2)C=C(C=C3Cl)Cl |
| InChIKey | AVKPJBRLHOBBGI-UHFFFAOYSA-N |
Chemical Property Profile of 1,3-Dichloro-dibenzothiophene
Property Insights of 1,3-Dichloro-dibenzothiophene
The XLogP value of 5.5 indicates that 1,3-Dichloro-dibenzothiophene is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. With a topological polar surface area (TPSA) of 28.2 Ų, 1,3-Dichloro-dibenzothiophene exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, 1,3-Dichloro-dibenzothiophene has 0 hydrogen bond donor(s) and 1 hydrogen bond acceptor(s), which may warrant consideration for formulation optimization.
Frequently Asked Questions
What is the CAS number of 1,3-Dichloro-dibenzothiophene?
The CAS number of 1,3-Dichloro-dibenzothiophene is 153524-14-2.
What is the molecular formula of 1,3-Dichloro-dibenzothiophene?
The molecular formula of 1,3-Dichloro-dibenzothiophene is C12H6Cl2S.
What is the molecular weight of 1,3-Dichloro-dibenzothiophene?
The molecular weight of 1,3-Dichloro-dibenzothiophene is 251.95673 g/mol.
Where can I buy 1,3-Dichloro-dibenzothiophene?
You can request a quote for 1,3-Dichloro-dibenzothiophene directly from CoreyChem. Contact us or email [email protected] for pricing and availability.
Does CoreyChem offer custom synthesis for 1,3-Dichloro-dibenzothiophene?
Yes, CoreyChem provides custom synthesis services for 1,3-Dichloro-dibenzothiophene and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.