Dimetan
TL;DR: Dimetan (CAS 122-15-6) is a chemical compound with molecular formula C11H17NO3 and molecular weight 211.12 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
(5,5-dimethyl-3-oxocyclohexen-1-yl) N,N-dimethylcarbamate
Also Known As: DIMETAN, Dimethan, Geigy 19258, DIMETAN [MI], ENT 24,728
| Molecular Formula | C11H17NO3 |
|---|---|
| Molecular Weight | 211.12 g/mol |
| LogP | 1.2 |
| Topological Polar Surface Area | 46.6 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 3 |
| Rotatable Bonds | 2 |
| Exact Mass | 211.12085 |
| Heavy Atoms | 15 |
| Complexity | 316.0 |
Chemical Identifiers
| CAS Number | 122-15-6 |
|---|---|
| SMILES | CC1(CC(=CC(=O)C1)OC(=O)N(C)C)C |
| InChIKey | ITEQSCBLCCNACE-UHFFFAOYSA-N |
Patent-Derived Application Labels
Derived from 6 IPC patent classification(s) across the SureChEMBL global patent database.
Product Overview
Dimetan (CAS 122-15-6), with molecular formula C11H17NO3 and molecular weight 211.12 g/mol. IUPAC: (5,5-dimethyl-3-oxocyclohexen-1-yl) N,N-dimethylcarbamate.
Chemical Property Profile of Dimetan
Property Insights of Dimetan
The XLogP value of 1.2 suggests moderate lipophilicity, balancing water solubility and membrane permeability for Dimetan. With a topological polar surface area (TPSA) of 46.6 Ų, Dimetan exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, Dimetan has 0 hydrogen bond donor(s) and 3 hydrogen bond acceptor(s), all within the drug-like range, suggesting favorable oral bioavailability potential.
Frequently Asked Questions
Frequently Asked Questions
What is the CAS number of Dimetan?
The CAS number of Dimetan is 122-15-6.
What is the molecular formula of Dimetan?
The molecular formula of Dimetan is C11H17NO3.
What is the molecular weight of Dimetan?
The molecular weight of Dimetan is 211.12 g/mol.
Where can I buy Dimetan?
You can request a quote for Dimetan directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for Dimetan?
Yes, KEHONG BIO provides custom synthesis services for Dimetan and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.