(E)-4,5-Dichloro-6-(dimethylamino)-3-methylhex-4-en-3-ol
TL;DR: (E)-4,5-Dichloro-6-(dimethylamino)-3-methylhex-4-en-3-ol (CAS 100156-17-0) is a chemical compound with molecular formula C9H17Cl2NO and molecular weight 225.07 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
(E)-4,5-dichloro-6-(dimethylamino)-3-methylhex-4-en-3-ol
Also Known As: (E)-4,5-Dichloro-6-(dimethylamino)-3-methylhex-4-en-3-ol, (E)-4,5-dichloro-6-dimethylamino-3-methyl-hex-4-en-3-ol
| Molecular Formula | C9H17Cl2NO |
|---|---|
| Molecular Weight | 225.07 g/mol |
| LogP | 2.3982 |
| Topological Polar Surface Area | 23.47 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 2 |
| Rotatable Bonds | 4 |
| Exact Mass | 225.06873 |
| Heavy Atoms | 13 |
| Complexity | 199.79138 |
Chemical Identifiers
| CAS Number | 100156-17-0 |
|---|---|
| SMILES | CCC(C)(/C(=C(/CN(C)C)\Cl)/Cl)O |
Product Overview
(E)-4,5-Dichloro-6-(dimethylamino)-3-methylhex-4-en-3-ol (CAS 100156-17-0), with molecular formula C9H17Cl2NO and molecular weight 225.07 g/mol. IUPAC: (E)-4,5-dichloro-6-(dimethylamino)-3-methylhex-4-en-3-ol.
Chemical Property Profile of (E)-4,5-Dichloro-6-(dimethylamino)-3-methylhex-4-en-3-ol
Property Insights of (E)-4,5-Dichloro-6-(dimethylamino)-3-methylhex-4-en-3-ol
The XLogP value of 2.3982 suggests moderate lipophilicity, balancing water solubility and membrane permeability for (E)-4,5-Dichloro-6-(dimethylamino)-3-methylhex-4-en-3-ol. With a topological polar surface area (TPSA) of 23.47 Ų, (E)-4,5-Dichloro-6-(dimethylamino)-3-methylhex-4-en-3-ol exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, (E)-4,5-Dichloro-6-(dimethylamino)-3-methylhex-4-en-3-ol has 1 hydrogen bond donor(s) and 2 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 (E)-4,5-Dichloro-6-(dimethylamino)-3-methylhex-4-en-3-ol?
The CAS number of (E)-4,5-Dichloro-6-(dimethylamino)-3-methylhex-4-en-3-ol is 100156-17-0.
What is the molecular formula of (E)-4,5-Dichloro-6-(dimethylamino)-3-methylhex-4-en-3-ol?
The molecular formula of (E)-4,5-Dichloro-6-(dimethylamino)-3-methylhex-4-en-3-ol is C9H17Cl2NO.
What is the molecular weight of (E)-4,5-Dichloro-6-(dimethylamino)-3-methylhex-4-en-3-ol?
The molecular weight of (E)-4,5-Dichloro-6-(dimethylamino)-3-methylhex-4-en-3-ol is 225.07 g/mol.
Where can I buy (E)-4,5-Dichloro-6-(dimethylamino)-3-methylhex-4-en-3-ol?
You can request a quote for (E)-4,5-Dichloro-6-(dimethylamino)-3-methylhex-4-en-3-ol directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for (E)-4,5-Dichloro-6-(dimethylamino)-3-methylhex-4-en-3-ol?
Yes, KEHONG BIO provides custom synthesis services for (E)-4,5-Dichloro-6-(dimethylamino)-3-methylhex-4-en-3-ol and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.