3-Penten-2-ol, 3,4-dibromo-2-methyl-5-(1-piperidinyl)-
TL;DR: 3-Penten-2-ol, 3,4-dibromo-2-methyl-5-(1-piperidinyl)- (CAS 96145-82-3) is a chemical compound with molecular formula C11H19Br2NO and molecular weight 338.98 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
(E)-3,4-dibromo-2-methyl-5-piperidin-1-ylpent-3-en-2-ol
Also Known As: 3-Penten-2-ol, 3,4-dibromo-2-methyl-5-(1-piperidinyl)-, (E)-3,4-dibromo-2-methyl-5-(1-piperidyl)pent-3-en-2-ol, (E)-3,4-dibromo-2-methyl-5-piperidin-1-ylpent-3-en-2-ol
| Molecular Formula | C11H19Br2NO |
|---|---|
| Molecular Weight | 338.98 g/mol |
| LogP | 3.2446 |
| Topological Polar Surface Area | 23.47 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 2 |
| Rotatable Bonds | 3 |
| Exact Mass | 338.98334 |
| Heavy Atoms | 15 |
| Complexity | 239.4627 |
Chemical Identifiers
| CAS Number | 96145-82-3 |
|---|---|
| SMILES | CC(C)(/C(=C(/CN1CCCCC1)\Br)/Br)O |
Product Overview
3-Penten-2-ol, 3,4-dibromo-2-methyl-5-(1-piperidinyl)- (CAS 96145-82-3), with molecular formula C11H19Br2NO and molecular weight 338.98 g/mol. IUPAC: (E)-3,4-dibromo-2-methyl-5-piperidin-1-ylpent-3-en-2-ol.
Chemical Property Profile of 3-Penten-2-ol, 3,4-dibromo-2-methyl-5-(1-piperidinyl)-
Property Insights of 3-Penten-2-ol, 3,4-dibromo-2-methyl-5-(1-piperidinyl)-
The XLogP value of 3.2446 indicates that 3-Penten-2-ol, 3,4-dibromo-2-methyl-5-(1-piperidinyl)- is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. With a topological polar surface area (TPSA) of 23.47 Ų, 3-Penten-2-ol, 3,4-dibromo-2-methyl-5-(1-piperidinyl)- exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, 3-Penten-2-ol, 3,4-dibromo-2-methyl-5-(1-piperidinyl)- 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 3-Penten-2-ol, 3,4-dibromo-2-methyl-5-(1-piperidinyl)-?
The CAS number of 3-Penten-2-ol, 3,4-dibromo-2-methyl-5-(1-piperidinyl)- is 96145-82-3.
What is the molecular formula of 3-Penten-2-ol, 3,4-dibromo-2-methyl-5-(1-piperidinyl)-?
The molecular formula of 3-Penten-2-ol, 3,4-dibromo-2-methyl-5-(1-piperidinyl)- is C11H19Br2NO.
What is the molecular weight of 3-Penten-2-ol, 3,4-dibromo-2-methyl-5-(1-piperidinyl)-?
The molecular weight of 3-Penten-2-ol, 3,4-dibromo-2-methyl-5-(1-piperidinyl)- is 338.98 g/mol.
Where can I buy 3-Penten-2-ol, 3,4-dibromo-2-methyl-5-(1-piperidinyl)-?
You can request a quote for 3-Penten-2-ol, 3,4-dibromo-2-methyl-5-(1-piperidinyl)- directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 3-Penten-2-ol, 3,4-dibromo-2-methyl-5-(1-piperidinyl)-?
Yes, KEHONG BIO provides custom synthesis services for 3-Penten-2-ol, 3,4-dibromo-2-methyl-5-(1-piperidinyl)- and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.