Indeno(3a,4-b)oxiren-4(1aH)-one, hexahydro-5,5,6,7,7-pentamethyl-
TL;DR: Indeno(3a,4-b)oxiren-4(1aH)-one, hexahydro-5,5,6,7,7-pentamethyl- (CAS 33704-62-0) is a chemical compound with molecular formula C14H22O2 and molecular weight 222.16 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
8,8,9,10,10-pentamethyl-2-oxatricyclo[5.3.0.01,3]decan-6-one
Also Known As: 4(3aH)-Indanone, 7,7a-epoxytetrahydro-1,1,2,3,3-pentamethyl-, 7,7a-Epoxytetrahydro-1,1,2,3,3-pentamethylindan-4(3aH)-one, Indeno(3a,4-b)oxiren-4(1aH)-one, hexahydro-5,5,6,7,7-pentamethyl-, Indeno[3a,4-b]oxiren-4(1aH)-one, hexahydro-5,5,6,7,7-pentamethyl-, 5,5,6,7,7-pentamethyl-octahydroindeno[4,3a-b]oxiren-4-one
| Molecular Formula | C14H22O2 |
|---|---|
| Molecular Weight | 222.16 g/mol |
| LogP | 2.6 |
| Topological Polar Surface Area | 29.6 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 2 |
| Rotatable Bonds | 0 |
| Exact Mass | 222.16199 |
| Heavy Atoms | 16 |
| Complexity | 369.0 |
Chemical Identifiers
| CAS Number | 33704-62-0 |
|---|---|
| SMILES | CC1C(C2C(=O)CCC3C2(C1(C)C)O3)(C)C |
| InChIKey | BWLNXEZTYZEVLK-UHFFFAOYSA-N |
Patent-Derived Application Labels
Derived from 1 IPC patent classification(s) across the SureChEMBL global patent database.
Product Overview
Indeno(3a,4-b)oxiren-4(1aH)-one, hexahydro-5,5,6,7,7-pentamethyl- (CAS 33704-62-0), with molecular formula C14H22O2 and molecular weight 222.16 g/mol. IUPAC: 8,8,9,10,10-pentamethyl-2-oxatricyclo[5.3.0.01,3]decan-6-one.
Chemical Property Profile of Indeno(3a,4-b)oxiren-4(1aH)-one, hexahydro-5,5,6,7,7-pentamethyl-
Property Insights of Indeno(3a,4-b)oxiren-4(1aH)-one, hexahydro-5,5,6,7,7-pentamethyl-
The XLogP value of 2.6 suggests moderate lipophilicity, balancing water solubility and membrane permeability for Indeno(3a,4-b)oxiren-4(1aH)-one, hexahydro-5,5,6,7,7-pentamethyl-. With a topological polar surface area (TPSA) of 29.6 Ų, Indeno(3a,4-b)oxiren-4(1aH)-one, hexahydro-5,5,6,7,7-pentamethyl- exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, Indeno(3a,4-b)oxiren-4(1aH)-one, hexahydro-5,5,6,7,7-pentamethyl- has 0 hydrogen bond donor(s) and 2 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 Indeno(3a,4-b)oxiren-4(1aH)-one, hexahydro-5,5,6,7,7-pentamethyl-?
The CAS number of Indeno(3a,4-b)oxiren-4(1aH)-one, hexahydro-5,5,6,7,7-pentamethyl- is 33704-62-0.
What is the molecular formula of Indeno(3a,4-b)oxiren-4(1aH)-one, hexahydro-5,5,6,7,7-pentamethyl-?
The molecular formula of Indeno(3a,4-b)oxiren-4(1aH)-one, hexahydro-5,5,6,7,7-pentamethyl- is C14H22O2.
What is the molecular weight of Indeno(3a,4-b)oxiren-4(1aH)-one, hexahydro-5,5,6,7,7-pentamethyl-?
The molecular weight of Indeno(3a,4-b)oxiren-4(1aH)-one, hexahydro-5,5,6,7,7-pentamethyl- is 222.16 g/mol.
Where can I buy Indeno(3a,4-b)oxiren-4(1aH)-one, hexahydro-5,5,6,7,7-pentamethyl-?
You can request a quote for Indeno(3a,4-b)oxiren-4(1aH)-one, hexahydro-5,5,6,7,7-pentamethyl- directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for Indeno(3a,4-b)oxiren-4(1aH)-one, hexahydro-5,5,6,7,7-pentamethyl-?
Yes, KEHONG BIO provides custom synthesis services for Indeno(3a,4-b)oxiren-4(1aH)-one, hexahydro-5,5,6,7,7-pentamethyl- and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.