3',5'-Diisopropyl-4,4-dimethyl-3-phenyl-1,2-benzocyclobuten-3-ol
TL;DR: 3',5'-Diisopropyl-4,4-dimethyl-3-phenyl-1,2-benzocyclobuten-3-ol (CAS 33574-16-2) is a chemical compound with molecular formula C22H28O and molecular weight 308.21 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
8,8-dimethyl-7-phenyl-3,5-di(propan-2-yl)bicyclo[4.2.0]octa-1,3,5-trien-7-ol
Also Known As: 3',5'-Diisopropyl-4,4-dimethyl-3-phenyl-1,2-benzocyclobuten-3-ol, 8,8-dimethyl-7-phenyl-3,5-di(propan-2-yl)bicyclo[4.2.0]octa-1,3,5-trien-7-ol, 1-Phenyl-2,2-dimethyl-4,6-diisopropyl-1,2-dihydrobenzocyclobuten-1-ol, 3,5-Diisopropyl-7-phenyl-8,8-dimethylbicyclo[4.2.0]octa-1,3,5-trien-7-ol, 7,7-dimethyl-8-phenyl-2,4-dipropan-2-yl-bicyclo[4.2.0]octa-1,3,5-trien-8-ol
| Molecular Formula | C22H28O |
|---|---|
| Molecular Weight | 308.21 g/mol |
| LogP | 4.4 |
| Topological Polar Surface Area | 20.2 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 1 |
| Rotatable Bonds | 3 |
| Exact Mass | 308.21402 |
| Heavy Atoms | 23 |
| Complexity | 418.0 |
Chemical Identifiers
| CAS Number | 33574-16-2 |
|---|---|
| SMILES | CC(C)C1=CC(=C2C(=C1)C(C2(C3=CC=CC=C3)O)(C)C)C(C)C |
| InChIKey | CTXNSPHJPSTTHQ-UHFFFAOYSA-N |
Product Overview
3',5'-Diisopropyl-4,4-dimethyl-3-phenyl-1,2-benzocyclobuten-3-ol (CAS 33574-16-2), with molecular formula C22H28O and molecular weight 308.21 g/mol. IUPAC: 8,8-dimethyl-7-phenyl-3,5-di(propan-2-yl)bicyclo[4.2.0]octa-1,3,5-trien-7-ol.
Chemical Property Profile of 3',5'-Diisopropyl-4,4-dimethyl-3-phenyl-1,2-benzocyclobuten-3-ol
Property Insights of 3',5'-Diisopropyl-4,4-dimethyl-3-phenyl-1,2-benzocyclobuten-3-ol
The XLogP value of 4.4 indicates that 3',5'-Diisopropyl-4,4-dimethyl-3-phenyl-1,2-benzocyclobuten-3-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, 3',5'-Diisopropyl-4,4-dimethyl-3-phenyl-1,2-benzocyclobuten-3-ol exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, 3',5'-Diisopropyl-4,4-dimethyl-3-phenyl-1,2-benzocyclobuten-3-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 3',5'-Diisopropyl-4,4-dimethyl-3-phenyl-1,2-benzocyclobuten-3-ol?
The CAS number of 3',5'-Diisopropyl-4,4-dimethyl-3-phenyl-1,2-benzocyclobuten-3-ol is 33574-16-2.
What is the molecular formula of 3',5'-Diisopropyl-4,4-dimethyl-3-phenyl-1,2-benzocyclobuten-3-ol?
The molecular formula of 3',5'-Diisopropyl-4,4-dimethyl-3-phenyl-1,2-benzocyclobuten-3-ol is C22H28O.
What is the molecular weight of 3',5'-Diisopropyl-4,4-dimethyl-3-phenyl-1,2-benzocyclobuten-3-ol?
The molecular weight of 3',5'-Diisopropyl-4,4-dimethyl-3-phenyl-1,2-benzocyclobuten-3-ol is 308.21 g/mol.
Where can I buy 3',5'-Diisopropyl-4,4-dimethyl-3-phenyl-1,2-benzocyclobuten-3-ol?
You can request a quote for 3',5'-Diisopropyl-4,4-dimethyl-3-phenyl-1,2-benzocyclobuten-3-ol directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 3',5'-Diisopropyl-4,4-dimethyl-3-phenyl-1,2-benzocyclobuten-3-ol?
Yes, KEHONG BIO provides custom synthesis services for 3',5'-Diisopropyl-4,4-dimethyl-3-phenyl-1,2-benzocyclobuten-3-ol and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.