endo-4-Bicyclo(2.2.1)hept-5-en-2-yl-3-buten-2-one
TL;DR: endo-4-Bicyclo(2.2.1)hept-5-en-2-yl-3-buten-2-one (CAS 58342-28-2) is a chemical compound with molecular formula C11H14O and molecular weight 162.10 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
(Z)-4-(2-bicyclo[2.2.1]hept-5-enyl)but-3-en-2-one
Also Known As: EINECS 261-219-7, endo-4-Bicyclo(2.2.1)hept-5-en-2-yl-3-buten-2-one, (Z)-4-(5-bicyclo[2.2.1]hept-2-enyl)but-3-en-2-one, (z)-4-(6-bicyclo[2.2.1]hept-2-enyl)but-3-en-2-one
| Molecular Formula | C11H14O |
|---|---|
| Molecular Weight | 162.10 g/mol |
| LogP | 2.3438 |
| Topological Polar Surface Area | 17.07 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 1 |
| Rotatable Bonds | 2 |
| Exact Mass | 162.10446 |
| Heavy Atoms | 12 |
| Complexity | 249.72972 |
Chemical Identifiers
| CAS Number | 58342-28-2 |
|---|---|
| SMILES | CC(=O)/C=C\C1CC2CC1C=C2 |
Product Overview
endo-4-Bicyclo(2.2.1)hept-5-en-2-yl-3-buten-2-one (CAS 58342-28-2), with molecular formula C11H14O and molecular weight 162.10 g/mol. IUPAC: (Z)-4-(2-bicyclo[2.2.1]hept-5-enyl)but-3-en-2-one.
Chemical Property Profile of endo-4-Bicyclo(2.2.1)hept-5-en-2-yl-3-buten-2-one
Property Insights of endo-4-Bicyclo(2.2.1)hept-5-en-2-yl-3-buten-2-one
The XLogP value of 2.3438 suggests moderate lipophilicity, balancing water solubility and membrane permeability for endo-4-Bicyclo(2.2.1)hept-5-en-2-yl-3-buten-2-one. With a topological polar surface area (TPSA) of 17.07 Ų, endo-4-Bicyclo(2.2.1)hept-5-en-2-yl-3-buten-2-one exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, endo-4-Bicyclo(2.2.1)hept-5-en-2-yl-3-buten-2-one has 0 hydrogen bond donor(s) and 1 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 endo-4-Bicyclo(2.2.1)hept-5-en-2-yl-3-buten-2-one?
The CAS number of endo-4-Bicyclo(2.2.1)hept-5-en-2-yl-3-buten-2-one is 58342-28-2.
What is the molecular formula of endo-4-Bicyclo(2.2.1)hept-5-en-2-yl-3-buten-2-one?
The molecular formula of endo-4-Bicyclo(2.2.1)hept-5-en-2-yl-3-buten-2-one is C11H14O.
What is the molecular weight of endo-4-Bicyclo(2.2.1)hept-5-en-2-yl-3-buten-2-one?
The molecular weight of endo-4-Bicyclo(2.2.1)hept-5-en-2-yl-3-buten-2-one is 162.10 g/mol.
Where can I buy endo-4-Bicyclo(2.2.1)hept-5-en-2-yl-3-buten-2-one?
You can request a quote for endo-4-Bicyclo(2.2.1)hept-5-en-2-yl-3-buten-2-one directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for endo-4-Bicyclo(2.2.1)hept-5-en-2-yl-3-buten-2-one?
Yes, KEHONG BIO provides custom synthesis services for endo-4-Bicyclo(2.2.1)hept-5-en-2-yl-3-buten-2-one and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.