4-Hexen-3-ol, 4,5-dibromo-3-methyl-6-(1-piperidinyl)-
TL;DR: 4-Hexen-3-ol, 4,5-dibromo-3-methyl-6-(1-piperidinyl)- (CAS 96145-83-4) is a chemical compound with molecular formula C12H21Br2NO and molecular weight 353.00 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
(E)-4,5-dibromo-3-methyl-6-piperidin-1-ylhex-4-en-3-ol
Also Known As: 4-Hexen-3-ol, 4,5-dibromo-3-methyl-6-(1-piperidinyl)-, (E)-4,5-dibromo-3-methyl-6-(1-piperidyl)hex-4-en-3-ol, (E)-4,5-dibromo-3-methyl-6-piperidin-1-ylhex-4-en-3-ol
| Molecular Formula | C12H21Br2NO |
|---|---|
| Molecular Weight | 353.00 g/mol |
| LogP | 3.6347 |
| Topological Polar Surface Area | 23.47 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 2 |
| Rotatable Bonds | 4 |
| Exact Mass | 352.999 |
| Heavy Atoms | 16 |
| Complexity | 257.7444 |
Chemical Identifiers
| CAS Number | 96145-83-4 |
|---|---|
| SMILES | CCC(C)(/C(=C(/CN1CCCCC1)\Br)/Br)O |
Product Overview
4-Hexen-3-ol, 4,5-dibromo-3-methyl-6-(1-piperidinyl)- (CAS 96145-83-4), with molecular formula C12H21Br2NO and molecular weight 353.00 g/mol. IUPAC: (E)-4,5-dibromo-3-methyl-6-piperidin-1-ylhex-4-en-3-ol.
Chemical Property Profile of 4-Hexen-3-ol, 4,5-dibromo-3-methyl-6-(1-piperidinyl)-
Property Insights of 4-Hexen-3-ol, 4,5-dibromo-3-methyl-6-(1-piperidinyl)-
The XLogP value of 3.6347 indicates that 4-Hexen-3-ol, 4,5-dibromo-3-methyl-6-(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, 4-Hexen-3-ol, 4,5-dibromo-3-methyl-6-(1-piperidinyl)- exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, 4-Hexen-3-ol, 4,5-dibromo-3-methyl-6-(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 4-Hexen-3-ol, 4,5-dibromo-3-methyl-6-(1-piperidinyl)-?
The CAS number of 4-Hexen-3-ol, 4,5-dibromo-3-methyl-6-(1-piperidinyl)- is 96145-83-4.
What is the molecular formula of 4-Hexen-3-ol, 4,5-dibromo-3-methyl-6-(1-piperidinyl)-?
The molecular formula of 4-Hexen-3-ol, 4,5-dibromo-3-methyl-6-(1-piperidinyl)- is C12H21Br2NO.
What is the molecular weight of 4-Hexen-3-ol, 4,5-dibromo-3-methyl-6-(1-piperidinyl)-?
The molecular weight of 4-Hexen-3-ol, 4,5-dibromo-3-methyl-6-(1-piperidinyl)- is 353.00 g/mol.
Where can I buy 4-Hexen-3-ol, 4,5-dibromo-3-methyl-6-(1-piperidinyl)-?
You can request a quote for 4-Hexen-3-ol, 4,5-dibromo-3-methyl-6-(1-piperidinyl)- directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 4-Hexen-3-ol, 4,5-dibromo-3-methyl-6-(1-piperidinyl)-?
Yes, KEHONG BIO provides custom synthesis services for 4-Hexen-3-ol, 4,5-dibromo-3-methyl-6-(1-piperidinyl)- and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.