3,5-Dinitrobenzoyl chloride
TL;DR: 3,5-Dinitrobenzoyl chloride (CAS 99-33-2) is a chemical compound with molecular formula C7H3ClN2O5 and molecular weight 229.97305 g/mol, supplied by CoreyChem (Career Henan Chemical Co., Ltd.) with ISO-certified quality and global shipping.
3,5-dinitrobenzoyl chloride
Also Known As: 3,5-Dinitrobenzoyl chloride, DNBC, 3,5-Dinitrobenzoic acid chloride, BENZOYL CHLORIDE, 3,5-DINITRO-, 3,5-Dinitrobenzoylchloride
Application Areas
Top 5 of 20 IPC patent classification(s) from the SureChEMBL global patent database.
Technical Specifications
| Molecular Formula | C7H3ClN2O5 |
| Molecular Weight | 229.97305 g/mol |
| XLogP | 2.5 |
| Topological Polar Surface Area (TPSA) | 109.0 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 5 |
| Rotatable Bonds | 1 |
| Exact Mass | 229.97305 Da |
| Heavy Atoms | 15 |
| Complexity | 275.0 |
| SMILES | C1=C(C=C(C=C1[N+](=O)[O-])[N+](=O)[O-])C(=O)Cl |
| InChIKey | NNOHXABAQAGKRZ-UHFFFAOYSA-N |
Product Description
Applications: 3,5-Dinitrobenzoyl chloride is used in complex organic molecule assembly across discovery and process chemistry, as well as heterocycle construction in medicinal chemistry and agrochemical discovery. 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).
3,5-Dinitrobenzoyl chloride is a organic building block identified by CAS number 99-33-2 and the molecular formula C7H3ClN2O5 and a molecular weight of 229.97 g/mol. Synonyms include 3,5-Dinitrobenzoyl chloride and DNBC.
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 3,5-Dinitrobenzoyl chloride
Property Insights of 3,5-Dinitrobenzoyl chloride
The XLogP value of 2.5 suggests moderate lipophilicity, balancing water solubility and membrane permeability for 3,5-Dinitrobenzoyl chloride. The TPSA of 109.0 Ų falls within the moderate polarity range, balancing permeability and solubility for 3,5-Dinitrobenzoyl chloride. Following Lipinski's Rule of Five, 3,5-Dinitrobenzoyl chloride has 0 hydrogen bond donor(s) and 5 hydrogen bond acceptor(s), all within the drug-like range, suggesting favorable oral bioavailability potential.
Frequently Asked Questions
What is the CAS number of 3,5-Dinitrobenzoyl chloride?
The CAS number of 3,5-Dinitrobenzoyl chloride is 99-33-2.
What is the molecular formula of 3,5-Dinitrobenzoyl chloride?
The molecular formula of 3,5-Dinitrobenzoyl chloride is C7H3ClN2O5.
What is the molecular weight of 3,5-Dinitrobenzoyl chloride?
The molecular weight of 3,5-Dinitrobenzoyl chloride is 229.97305 g/mol.
What are the applications of 3,5-Dinitrobenzoyl chloride?
3,5-Dinitrobenzoyl chloride is used in complex organic molecule assembly across discovery and process chemistry, as well as heterocycle construction in medicinal chemistry and agrochemical discovery. It commonly serves as a versatile building block for organic synthesis. Available from CoreyChem...
Where can I buy 3,5-Dinitrobenzoyl chloride?
You can request a quote for 3,5-Dinitrobenzoyl chloride directly from CoreyChem. Contact us or email [email protected] for pricing and availability.
Does CoreyChem offer custom synthesis for 3,5-Dinitrobenzoyl chloride?
Yes, CoreyChem provides custom synthesis services for 3,5-Dinitrobenzoyl chloride and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.