4,5-Dichloro-1,2-methylenedioxybenzene
TL;DR: 4,5-Dichloro-1,2-methylenedioxybenzene (CAS 6120-31-6) is a chemical compound with molecular formula C7H4Cl2O2 and molecular weight 189.95883 g/mol, supplied by CoreyChem (Career Henan Chemical Co., Ltd.) with ISO-certified quality and global shipping.
5,6-dichloro-1,3-benzodioxole
Also Known As: 5,6-Dichlorobenzo[d][1,3]dioxole, 5,6-dichloro-1,3-benzodioxole, 5,6-DICHLOROBENZO(1,3)DIOXOLE, 4,5-Dcmdb, 5,6-dichloro-2H-1,3-benzodioxole
Application Areas
Top 5 of 1 IPC patent classification(s) from the SureChEMBL global patent database.
Technical Specifications
| Molecular Formula | C7H4Cl2O2 |
| Molecular Weight | 189.95883 g/mol |
| XLogP | 3.0 |
| Topological Polar Surface Area (TPSA) | 18.5 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 2 |
| Rotatable Bonds | 0 |
| Exact Mass | 189.95883 Da |
| Heavy Atoms | 11 |
| Complexity | 137.0 |
| SMILES | C1OC2=CC(=C(C=C2O1)Cl)Cl |
| InChIKey | DVMBKYXRFLTGEH-UHFFFAOYSA-N |
Chemical Property Profile of 4,5-Dichloro-1,2-methylenedioxybenzene
Property Insights of 4,5-Dichloro-1,2-methylenedioxybenzene
The XLogP value of 3.0 indicates that 4,5-Dichloro-1,2-methylenedioxybenzene is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. With a topological polar surface area (TPSA) of 18.5 Ų, 4,5-Dichloro-1,2-methylenedioxybenzene exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, 4,5-Dichloro-1,2-methylenedioxybenzene 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
What is the CAS number of 4,5-Dichloro-1,2-methylenedioxybenzene?
The CAS number of 4,5-Dichloro-1,2-methylenedioxybenzene is 6120-31-6.
What is the molecular formula of 4,5-Dichloro-1,2-methylenedioxybenzene?
The molecular formula of 4,5-Dichloro-1,2-methylenedioxybenzene is C7H4Cl2O2.
What is the molecular weight of 4,5-Dichloro-1,2-methylenedioxybenzene?
The molecular weight of 4,5-Dichloro-1,2-methylenedioxybenzene is 189.95883 g/mol.
Where can I buy 4,5-Dichloro-1,2-methylenedioxybenzene?
You can request a quote for 4,5-Dichloro-1,2-methylenedioxybenzene directly from CoreyChem. Contact us or email [email protected] for pricing and availability.
Does CoreyChem offer custom synthesis for 4,5-Dichloro-1,2-methylenedioxybenzene?
Yes, CoreyChem provides custom synthesis services for 4,5-Dichloro-1,2-methylenedioxybenzene and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.