![4,7,7-Trimethyl-2-(3-methylbut-2-EN-1-YL)bicyclo[4.1.0]heptan-3-one structure](/static/products/7449/74499-58-4.webp)
4,7,7-Trimethyl-2-(3-methylbut-2-EN-1-YL)bicyclo[4.1.0]heptan-3-one
TL;DR: 4,7,7-Trimethyl-2-(3-methylbut-2-EN-1-YL)bicyclo[4.1.0]heptan-3-one (CAS 74499-58-4) is a chemical compound with molecular formula C15H24O and molecular weight 220.18 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
4,7,7-trimethyl-2-(3-methylbut-2-enyl)bicyclo[4.1.0]heptan-3-one
Also Known As: 4,7,7-trimethyl-2- bicyclo[4.1.0]heptan-3-one, Bicyclo[4.1.0]heptan-3-one, 4,7,7-trimethyl-2-(3-methyl-2-buten-1-yl)-, 4,7,7-trimethyl-2-(3-methylbut-2-enyl)bicyclo[4.1.0]heptan-3-one, 4,7,7-TRIMETHYL-2-(3-METHYL-2-BUTENYL)BICYCLO[4.1.0]HEPTAN-3-ONE, Bicyclo[4.1.0]heptan-3-one, 4,7,7-trimethyl-2-(3-methyl-2-butenyl)-
| Molecular Formula | C15H24O |
|---|---|
| Molecular Weight | 220.18 g/mol |
| LogP | 4.1 |
| Topological Polar Surface Area | 17.1 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 1 |
| Rotatable Bonds | 2 |
| Exact Mass | 220.18271 |
| Heavy Atoms | 16 |
| Complexity | 333.0 |
Chemical Identifiers
| CAS Number | 74499-58-4 |
|---|---|
| SMILES | CC1CC2C(C2(C)C)C(C1=O)CC=C(C)C |
| InChIKey | HCRHVSPDKOSFIT-UHFFFAOYSA-N |
Patent-Derived Application Labels
Derived from 3 IPC patent classification(s) across the SureChEMBL global patent database.
Product Overview
4,7,7-Trimethyl-2-(3-methylbut-2-EN-1-YL)bicyclo[4.1.0]heptan-3-one (CAS 74499-58-4), with molecular formula C15H24O and molecular weight 220.18 g/mol. IUPAC: 4,7,7-trimethyl-2-(3-methylbut-2-enyl)bicyclo[4.1.0]heptan-3-one.
Chemical Property Profile of 4,7,7-Trimethyl-2-(3-methylbut-2-EN-1-YL)bicyclo[4.1.0]heptan-3-one
Property Insights of 4,7,7-Trimethyl-2-(3-methylbut-2-EN-1-YL)bicyclo[4.1.0]heptan-3-one
The XLogP value of 4.1 indicates that 4,7,7-Trimethyl-2-(3-methylbut-2-EN-1-YL)bicyclo[4.1.0]heptan-3-one is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. With a topological polar surface area (TPSA) of 17.1 Ų, 4,7,7-Trimethyl-2-(3-methylbut-2-EN-1-YL)bicyclo[4.1.0]heptan-3-one exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, 4,7,7-Trimethyl-2-(3-methylbut-2-EN-1-YL)bicyclo[4.1.0]heptan-3-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 4,7,7-Trimethyl-2-(3-methylbut-2-EN-1-YL)bicyclo[4.1.0]heptan-3-one?
The CAS number of 4,7,7-Trimethyl-2-(3-methylbut-2-EN-1-YL)bicyclo[4.1.0]heptan-3-one is 74499-58-4.
What is the molecular formula of 4,7,7-Trimethyl-2-(3-methylbut-2-EN-1-YL)bicyclo[4.1.0]heptan-3-one?
The molecular formula of 4,7,7-Trimethyl-2-(3-methylbut-2-EN-1-YL)bicyclo[4.1.0]heptan-3-one is C15H24O.
What is the molecular weight of 4,7,7-Trimethyl-2-(3-methylbut-2-EN-1-YL)bicyclo[4.1.0]heptan-3-one?
The molecular weight of 4,7,7-Trimethyl-2-(3-methylbut-2-EN-1-YL)bicyclo[4.1.0]heptan-3-one is 220.18 g/mol.
Where can I buy 4,7,7-Trimethyl-2-(3-methylbut-2-EN-1-YL)bicyclo[4.1.0]heptan-3-one?
You can request a quote for 4,7,7-Trimethyl-2-(3-methylbut-2-EN-1-YL)bicyclo[4.1.0]heptan-3-one directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 4,7,7-Trimethyl-2-(3-methylbut-2-EN-1-YL)bicyclo[4.1.0]heptan-3-one?
Yes, KEHONG BIO provides custom synthesis services for 4,7,7-Trimethyl-2-(3-methylbut-2-EN-1-YL)bicyclo[4.1.0]heptan-3-one and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.