Dimenhydrinate
TL;DR: Dimenhydrinate (CAS 523-87-5) is a chemical compound with molecular formula C24H28ClN5O3 and molecular weight 469.18808 g/mol, supplied by CoreyChem (Career Henan Chemical Co., Ltd.) with ISO-certified quality and global shipping.
2-benzhydryloxy-N,N-dimethylethanamine;8-chloro-1,3-dimethyl-7H-purine-2,6-dione
Also Known As: DIMENHYDRINATE, Dramamine, Travelin, Diphenhydrinate, Anautine
Application Areas
Top 5 of 20 IPC patent classification(s) from the SureChEMBL global patent database.
Technical Specifications
| Molecular Formula | C24H28ClN5O3 |
| Molecular Weight | 469.18808 g/mol |
| XLogP | 2.97 |
| Topological Polar Surface Area (TPSA) | 81.8 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 5 |
| Rotatable Bonds | 6 |
| Exact Mass | 469.18808 Da |
| Heavy Atoms | 33 |
| Complexity | 509.0 |
| Melting Point | 216 to 225 °F (NTP, 1992) |
| Solubility | Slightly soluble (1-10 mg/ml at 72 °F) (NTP, 1992) |
| SMILES | CN1C2=C(C(=O)N(C1=O)C)NC(=N2)Cl.CN(C)CCOC(C1=CC=CC=C1)C2=CC=CC=C2 |
| InChIKey | NFLLKCVHYJRNRH-UHFFFAOYSA-N |
Product Description
Applications: Dimenhydrinate is used in pharmaceutical synthesis routes and API production, 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).
Dimenhydrinate (CAS 523-87-5) is a pharmaceutical intermediate with the molecular formula C24H28ClN5O3 and a molecular weight of 469.19 g/mol. Key physical properties include a solubility: Slightly soluble (1-10 mg/ml at 72 °F) (NTP, 1992). Synonyms include DIMENHYDRINATE and Dramamine.
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 Dimenhydrinate
Property Insights of Dimenhydrinate
The XLogP value of 2.97 suggests moderate lipophilicity, balancing water solubility and membrane permeability for Dimenhydrinate. The TPSA of 81.8 Ų falls within the moderate polarity range, balancing permeability and solubility for Dimenhydrinate. Following Lipinski's Rule of Five, Dimenhydrinate has 1 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 Dimenhydrinate?
The CAS number of Dimenhydrinate is 523-87-5.
What is the molecular formula of Dimenhydrinate?
The molecular formula of Dimenhydrinate is C24H28ClN5O3.
What is the molecular weight of Dimenhydrinate?
The molecular weight of Dimenhydrinate is 469.18808 g/mol.
What are the applications of Dimenhydrinate?
Dimenhydrinate is used in pharmaceutical synthesis routes and API production, 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...
Where can I buy Dimenhydrinate?
You can request a quote for Dimenhydrinate directly from CoreyChem. Contact us or email [email protected] for pricing and availability.
Does CoreyChem offer custom synthesis for Dimenhydrinate?
Yes, CoreyChem provides custom synthesis services for Dimenhydrinate and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.