Decahydro-3,3,4,7a-tetramethyl-1H-cyclopenta[a]pentalen-7-ol
TL;DR: Decahydro-3,3,4,7a-tetramethyl-1H-cyclopenta[a]pentalen-7-ol (CAS 58003-47-7) is a chemical compound with molecular formula C22H32O3S and molecular weight 376.21 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
(3,4,4,6a-tetramethyl-2,3,3a,3b,5,6,7,7a-octahydro-1H-cyclopenta[a]pentalen-7-yl) 4-methylbenzenesulfonate
Also Known As: Decahydro-3,3,4,7a-tetramethyl-1H-cyclopenta[a]pentalen-7-ol, 1H-Cyclopenta[a]pentalen-7-ol, decahydro-3,3,4,7a-tetramethyl-, 4-methylbenzenesulfonate, 3,3,4,7a-Tetramethyldecahydro-1H-cyclopenta[a]pentalen-7-yl 4-methylbenzenesulfonate, 3,3,4,7a-Tetramethyldecahydro-1H-cyclopenta[a]pentalen-7-yl 4-methylbenzenesulfonate #, 3,3,6,11-tetramethyltricyclo[6.3.0.02,6]undecan-7-yl 4-methylbenzene-1-sulfonate
| Molecular Formula | C22H32O3S |
|---|---|
| Molecular Weight | 376.21 g/mol |
| LogP | 6.2 |
| Topological Polar Surface Area | 51.8 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 3 |
| Rotatable Bonds | 3 |
| Exact Mass | 376.2072 |
| Heavy Atoms | 26 |
| Complexity | 641.0 |
Chemical Identifiers
| CAS Number | 58003-47-7 |
|---|---|
| SMILES | CC1CCC2C1C3C(CCC3(C2OS(=O)(=O)C4=CC=C(C=C4)C)C)(C)C |
| InChIKey | OPYXRRSBTLKZMB-UHFFFAOYSA-N |
Product Overview
Decahydro-3,3,4,7a-tetramethyl-1H-cyclopenta[a]pentalen-7-ol (CAS 58003-47-7), with molecular formula C22H32O3S and molecular weight 376.21 g/mol. IUPAC: (3,4,4,6a-tetramethyl-2,3,3a,3b,5,6,7,7a-octahydro-1H-cyclopenta[a]pentalen-7-yl) 4-methylbenzenesulfonate.
Chemical Property Profile of Decahydro-3,3,4,7a-tetramethyl-1H-cyclopenta[a]pentalen-7-ol
Property Insights of Decahydro-3,3,4,7a-tetramethyl-1H-cyclopenta[a]pentalen-7-ol
The XLogP value of 6.2 indicates that Decahydro-3,3,4,7a-tetramethyl-1H-cyclopenta[a]pentalen-7-ol is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. With a topological polar surface area (TPSA) of 51.8 Ų, Decahydro-3,3,4,7a-tetramethyl-1H-cyclopenta[a]pentalen-7-ol exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, Decahydro-3,3,4,7a-tetramethyl-1H-cyclopenta[a]pentalen-7-ol has 0 hydrogen bond donor(s) and 3 hydrogen bond acceptor(s), which may warrant consideration for formulation optimization.
Frequently Asked Questions
Frequently Asked Questions
What is the CAS number of Decahydro-3,3,4,7a-tetramethyl-1H-cyclopenta[a]pentalen-7-ol?
The CAS number of Decahydro-3,3,4,7a-tetramethyl-1H-cyclopenta[a]pentalen-7-ol is 58003-47-7.
What is the molecular formula of Decahydro-3,3,4,7a-tetramethyl-1H-cyclopenta[a]pentalen-7-ol?
The molecular formula of Decahydro-3,3,4,7a-tetramethyl-1H-cyclopenta[a]pentalen-7-ol is C22H32O3S.
What is the molecular weight of Decahydro-3,3,4,7a-tetramethyl-1H-cyclopenta[a]pentalen-7-ol?
The molecular weight of Decahydro-3,3,4,7a-tetramethyl-1H-cyclopenta[a]pentalen-7-ol is 376.21 g/mol.
Where can I buy Decahydro-3,3,4,7a-tetramethyl-1H-cyclopenta[a]pentalen-7-ol?
You can request a quote for Decahydro-3,3,4,7a-tetramethyl-1H-cyclopenta[a]pentalen-7-ol directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for Decahydro-3,3,4,7a-tetramethyl-1H-cyclopenta[a]pentalen-7-ol?
Yes, KEHONG BIO provides custom synthesis services for Decahydro-3,3,4,7a-tetramethyl-1H-cyclopenta[a]pentalen-7-ol and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.