![1-{Bicyclo[2.2.1]hept-5-en-2-yl}propan-2-one structure](/static/products/7793/77936-56-2.webp)
1-{Bicyclo[2.2.1]hept-5-en-2-yl}propan-2-one
TL;DR: 1-{Bicyclo[2.2.1]hept-5-en-2-yl}propan-2-one (CAS 77936-56-2) is a chemical compound with molecular formula C10H14O and molecular weight 150.10 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
1-(2-bicyclo[2.2.1]hept-5-enyl)propan-2-one
Also Known As: 5-norbornenylacetone, 3-(5-norbornen-2-yl)acetone, 1-{bicyclo[2.2.1]hept-5-en-2-yl}propan-2-one, 1-bicyclo[2.2.1]hept-5-en-2-ylacetone, 1-(Bicyclo[2.2.1]hept-5-en-2-yl)propan-2-one
| Molecular Formula | C10H14O |
|---|---|
| Molecular Weight | 150.10 g/mol |
| LogP | 2.1777 |
| Topological Polar Surface Area | 17.07 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 1 |
| Rotatable Bonds | 2 |
| Exact Mass | 150.10446 |
| Heavy Atoms | 11 |
| Complexity | 204.91832 |
Chemical Identifiers
| CAS Number | 77936-56-2 |
|---|---|
| SMILES | CC(=O)CC1CC2CC1C=C2 |
Product Overview
1-{Bicyclo[2.2.1]hept-5-en-2-yl}propan-2-one (CAS 77936-56-2), with molecular formula C10H14O and molecular weight 150.10 g/mol. IUPAC: 1-(2-bicyclo[2.2.1]hept-5-enyl)propan-2-one.
Chemical Property Profile of 1-{Bicyclo[2.2.1]hept-5-en-2-yl}propan-2-one
Property Insights of 1-{Bicyclo[2.2.1]hept-5-en-2-yl}propan-2-one
The XLogP value of 2.1777 suggests moderate lipophilicity, balancing water solubility and membrane permeability for 1-{Bicyclo[2.2.1]hept-5-en-2-yl}propan-2-one. With a topological polar surface area (TPSA) of 17.07 Ų, 1-{Bicyclo[2.2.1]hept-5-en-2-yl}propan-2-one exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, 1-{Bicyclo[2.2.1]hept-5-en-2-yl}propan-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 1-{Bicyclo[2.2.1]hept-5-en-2-yl}propan-2-one?
The CAS number of 1-{Bicyclo[2.2.1]hept-5-en-2-yl}propan-2-one is 77936-56-2.
What is the molecular formula of 1-{Bicyclo[2.2.1]hept-5-en-2-yl}propan-2-one?
The molecular formula of 1-{Bicyclo[2.2.1]hept-5-en-2-yl}propan-2-one is C10H14O.
What is the molecular weight of 1-{Bicyclo[2.2.1]hept-5-en-2-yl}propan-2-one?
The molecular weight of 1-{Bicyclo[2.2.1]hept-5-en-2-yl}propan-2-one is 150.10 g/mol.
Where can I buy 1-{Bicyclo[2.2.1]hept-5-en-2-yl}propan-2-one?
You can request a quote for 1-{Bicyclo[2.2.1]hept-5-en-2-yl}propan-2-one directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 1-{Bicyclo[2.2.1]hept-5-en-2-yl}propan-2-one?
Yes, KEHONG BIO provides custom synthesis services for 1-{Bicyclo[2.2.1]hept-5-en-2-yl}propan-2-one and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.