![4-(3,3-Dimethylbicyclo[2.2.1]heptan-2-ylidene)-2-methylbut-2-en-1-ol structure](/static/products/5503/5503-13-9.webp)
4-(3,3-Dimethylbicyclo[2.2.1]heptan-2-ylidene)-2-methylbut-2-en-1-ol
TL;DR: 4-(3,3-Dimethylbicyclo[2.2.1]heptan-2-ylidene)-2-methylbut-2-en-1-ol (CAS 5503-13-9) is a chemical compound with molecular formula C14H22O and molecular weight 206.17 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
4-(3,3-dimethyl-2-bicyclo[2.2.1]heptanylidene)-2-methylbut-2-en-1-ol
Also Known As: 4-(3,3-DIMETHYLBICYCLO[2.2.1]HEPT-2-YLIDENE)-2-METHYL-2-BUTEN-1-OL, 2-Buten-1-ol, 4-(3,3-dimethylbicyclo(2.2.1)hept-2-ylidene)-2-methyl-, 2-Buten-1-ol,4-(3,3-dimethylbicyclo[2.2.1]hept-2-ylidene)-2-methyl-, 4-(3,3-Dimethylbicyclo(2.2.1)hept-2-ylidene)-2-methyl-2-buten-1-ol, 4-(3,3-Dimethylbicyclo[2.2.1]heptan-2-ylidene)-2-methylbut-2-en-1-ol
| Molecular Formula | C14H22O |
|---|---|
| Molecular Weight | 206.17 g/mol |
| LogP | 3.6 |
| Topological Polar Surface Area | 20.2 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 1 |
| Rotatable Bonds | 2 |
| Exact Mass | 206.16707 |
| Heavy Atoms | 15 |
| Complexity | 309.0 |
Chemical Identifiers
| CAS Number | 5503-13-9 |
|---|---|
| SMILES | CC(=CC=C1C2CCC(C2)C1(C)C)CO |
| InChIKey | XOPZRHLPPJYQQI-UHFFFAOYSA-N |
Product Overview
4-(3,3-Dimethylbicyclo[2.2.1]heptan-2-ylidene)-2-methylbut-2-en-1-ol (CAS 5503-13-9), with molecular formula C14H22O and molecular weight 206.17 g/mol. IUPAC: 4-(3,3-dimethyl-2-bicyclo[2.2.1]heptanylidene)-2-methylbut-2-en-1-ol.
Chemical Property Profile of 4-(3,3-Dimethylbicyclo[2.2.1]heptan-2-ylidene)-2-methylbut-2-en-1-ol
Property Insights of 4-(3,3-Dimethylbicyclo[2.2.1]heptan-2-ylidene)-2-methylbut-2-en-1-ol
The XLogP value of 3.6 indicates that 4-(3,3-Dimethylbicyclo[2.2.1]heptan-2-ylidene)-2-methylbut-2-en-1-ol is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. With a topological polar surface area (TPSA) of 20.2 Ų, 4-(3,3-Dimethylbicyclo[2.2.1]heptan-2-ylidene)-2-methylbut-2-en-1-ol exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, 4-(3,3-Dimethylbicyclo[2.2.1]heptan-2-ylidene)-2-methylbut-2-en-1-ol has 1 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 4-(3,3-Dimethylbicyclo[2.2.1]heptan-2-ylidene)-2-methylbut-2-en-1-ol?
The CAS number of 4-(3,3-Dimethylbicyclo[2.2.1]heptan-2-ylidene)-2-methylbut-2-en-1-ol is 5503-13-9.
What is the molecular formula of 4-(3,3-Dimethylbicyclo[2.2.1]heptan-2-ylidene)-2-methylbut-2-en-1-ol?
The molecular formula of 4-(3,3-Dimethylbicyclo[2.2.1]heptan-2-ylidene)-2-methylbut-2-en-1-ol is C14H22O.
What is the molecular weight of 4-(3,3-Dimethylbicyclo[2.2.1]heptan-2-ylidene)-2-methylbut-2-en-1-ol?
The molecular weight of 4-(3,3-Dimethylbicyclo[2.2.1]heptan-2-ylidene)-2-methylbut-2-en-1-ol is 206.17 g/mol.
Where can I buy 4-(3,3-Dimethylbicyclo[2.2.1]heptan-2-ylidene)-2-methylbut-2-en-1-ol?
You can request a quote for 4-(3,3-Dimethylbicyclo[2.2.1]heptan-2-ylidene)-2-methylbut-2-en-1-ol directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 4-(3,3-Dimethylbicyclo[2.2.1]heptan-2-ylidene)-2-methylbut-2-en-1-ol?
Yes, KEHONG BIO provides custom synthesis services for 4-(3,3-Dimethylbicyclo[2.2.1]heptan-2-ylidene)-2-methylbut-2-en-1-ol and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.