Benzene, 1,2-dichloro-4-methyl-
TL;DR: Benzene, 1,2-dichloro-4-methyl- (CAS 95-75-0) is a chemical compound with molecular formula C7H6Cl2 and molecular weight 159.98465 g/mol, supplied by CoreyChem (Career Henan Chemical Co., Ltd.) with ISO-certified quality and global shipping.
1,2-dichloro-4-methylbenzene
Also Known As: 3,4-DICHLOROTOLUENE, 1,2-Dichloro-4-methylbenzene, Benzene, 1,2-dichloro-4-methyl-, Toluene, 3,4-dichloro-, 3,4-dichlortoluen
Application Areas
Top 5 of 17 IPC patent classification(s) from the SureChEMBL global patent database.
Technical Specifications
| Molecular Formula | C7H6Cl2 |
| Molecular Weight | 159.98465 g/mol |
| XLogP | 4.0 |
| Topological Polar Surface Area (TPSA) | 0.0 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 0 |
| Rotatable Bonds | 0 |
| Exact Mass | 159.98465 Da |
| Heavy Atoms | 9 |
| Complexity | 92.0 |
| SMILES | CC1=CC(=C(C=C1)Cl)Cl |
| InChIKey | WYUIWKFIFOJVKW-UHFFFAOYSA-N |
Product Description
Applications: Benzene, 1,2-dichloro-4-methyl- is used in heterocycle construction in medicinal chemistry and agrochemical discovery, as well as complex organic molecule assembly across discovery and process chemistry. It commonly serves as a versatile building block for organic synthesis. Available from CoreyChem as both catalog item and custom-synthesis project (mg to ton scale), with full analytical documentation (COA, MSDS, HPLC, NMR, MS).
Benzene, 1,2-dichloro-4-methyl- (CAS 95-75-0) is a heterocyclic building block with the molecular formula C7H6Cl2 and a molecular weight of 159.98 g/mol. Synonyms include 3,4-DICHLOROTOLUENE and 1,2-Dichloro-4-methylbenzene.
Custom synthesis and full analytical documentation (COA/MSDS) are available from CoreyChem. Request a quotation with your required quantity and purity for current lead time and pricing.
Chemical Property Profile of Benzene, 1,2-dichloro-4-methyl-
Property Insights of Benzene, 1,2-dichloro-4-methyl-
The XLogP value of 4.0 indicates that Benzene, 1,2-dichloro-4-methyl- is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. With a topological polar surface area (TPSA) of 0.0 Ų, Benzene, 1,2-dichloro-4-methyl- exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, Benzene, 1,2-dichloro-4-methyl- has 0 hydrogen bond donor(s) and 0 hydrogen bond acceptor(s), all within the drug-like range, suggesting favorable oral bioavailability potential.
Frequently Asked Questions
What is the CAS number of Benzene, 1,2-dichloro-4-methyl-?
The CAS number of Benzene, 1,2-dichloro-4-methyl- is 95-75-0.
What is the molecular formula of Benzene, 1,2-dichloro-4-methyl-?
The molecular formula of Benzene, 1,2-dichloro-4-methyl- is C7H6Cl2.
What is the molecular weight of Benzene, 1,2-dichloro-4-methyl-?
The molecular weight of Benzene, 1,2-dichloro-4-methyl- is 159.98465 g/mol.
What are the applications of Benzene, 1,2-dichloro-4-methyl-?
Benzene, 1,2-dichloro-4-methyl- is used in heterocycle construction in medicinal chemistry and agrochemical discovery, as well as complex organic molecule assembly across discovery and process chemistry. It commonly serves as a versatile building block for organic synthesis. Available from...
Where can I buy Benzene, 1,2-dichloro-4-methyl-?
You can request a quote for Benzene, 1,2-dichloro-4-methyl- directly from CoreyChem. Contact us or email [email protected] for pricing and availability.
Does CoreyChem offer custom synthesis for Benzene, 1,2-dichloro-4-methyl-?
Yes, CoreyChem provides custom synthesis services for Benzene, 1,2-dichloro-4-methyl- and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.