1,2-dichlorodecane
TL;DR: 1,2-dichlorodecane (CAS 27953-46-4) is a chemical compound with molecular formula C10H14N2O2S and molecular weight 226.08 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
ethyl 2-amino-4,5,6,7-tetrahydrothieno[2,3-c]pyridine-3-carboxylate
Also Known As: 1,2-dichlorodecane, ethyl 2-amino-4,5,6,7-tetrahydrothieno[2,3-c]pyridine-3-carboxylate, Nor-Y 3642, ethyl 2-amino-4h,5h,6h,7h-thieno[2,3-c]pyridine-3-carboxylate, J3.432.946J
| Molecular Formula | C10H14N2O2S |
|---|---|
| Molecular Weight | 226.08 g/mol |
| LogP | 1.5 |
| Topological Polar Surface Area | 92.6 Ų |
| Hydrogen Bond Donors | 2 |
| Hydrogen Bond Acceptors | 5 |
| Rotatable Bonds | 3 |
| Exact Mass | 226.0776 |
| Heavy Atoms | 15 |
| Complexity | 250.0 |
Chemical Identifiers
| CAS Number | 27953-46-4 |
|---|---|
| SMILES | CCOC(=O)C1=C(SC2=C1CCNC2)N |
| InChIKey | PVISNLMZGPDDEI-UHFFFAOYSA-N |
Patent-Derived Application Labels
Derived from 2 IPC patent classification(s) across the SureChEMBL global patent database.
Product Overview
1,2-dichlorodecane (CAS 27953-46-4), with molecular formula C10H14N2O2S and molecular weight 226.08 g/mol. IUPAC: ethyl 2-amino-4,5,6,7-tetrahydrothieno[2,3-c]pyridine-3-carboxylate.
Chemical Property Profile of 1,2-dichlorodecane
Property Insights of 1,2-dichlorodecane
The XLogP value of 1.5 suggests moderate lipophilicity, balancing water solubility and membrane permeability for 1,2-dichlorodecane. The TPSA of 92.6 Ų falls within the moderate polarity range, balancing permeability and solubility for 1,2-dichlorodecane. Following Lipinski's Rule of Five, 1,2-dichlorodecane has 2 hydrogen bond donor(s) and 5 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 1,2-dichlorodecane?
The CAS number of 1,2-dichlorodecane is 27953-46-4.
What is the molecular formula of 1,2-dichlorodecane?
The molecular formula of 1,2-dichlorodecane is C10H14N2O2S.
What is the molecular weight of 1,2-dichlorodecane?
The molecular weight of 1,2-dichlorodecane is 226.08 g/mol.
Where can I buy 1,2-dichlorodecane?
You can request a quote for 1,2-dichlorodecane directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 1,2-dichlorodecane?
Yes, KEHONG BIO provides custom synthesis services for 1,2-dichlorodecane and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.