Squamulosone
TL;DR: Squamulosone (CAS 34413-94-0) is a chemical compound with molecular formula C15H22O and molecular weight 218.17 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
(1aR,7R,7aS,7bR)-1,1,4,7-tetramethyl-2,5,6,7,7a,7b-hexahydro-1aH-cyclopropa[e]azulen-3-one
Also Known As: Squamulosone, Aromadendr-1(10)-en-9-one, (1aR,7R,7aS,7bR)-1,1,4,7-tetramethyl-2,5,6,7,7a,7b-hexahydro-1aH-cyclopropa[e]azulen-3-one, (1aR)-1,1abeta,2,5,6,7,7aalpha,7bbeta-Octahydro-1,1,4,7beta-tetramethyl-3H-cycloprop[e]azulen-3-one, (1aR,7R,7aS,7bR)-1,1,4,7-Tetramethyl-1,1a,2,5,6,7,7a,7b-octahydro-3H-cyclopropa[e]azulen-3-one
| Molecular Formula | C15H22O |
|---|---|
| Molecular Weight | 218.17 g/mol |
| LogP | 3.1 |
| Topological Polar Surface Area | 17.1 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 1 |
| Rotatable Bonds | 0 |
| Exact Mass | 218.16707 |
| Heavy Atoms | 16 |
| Complexity | 388.0 |
Chemical Identifiers
| CAS Number | 34413-94-0 |
|---|---|
| SMILES | C[C@@H]1CCC2=C(C(=O)C[C@@H]3[C@H]([C@H]12)C3(C)C)C |
| InChIKey | FUIPJCVSKAWFTI-KLPZLMTLSA-N |
Product Overview
Squamulosone (CAS 34413-94-0), with molecular formula C15H22O and molecular weight 218.17 g/mol. IUPAC: (1aR,7R,7aS,7bR)-1,1,4,7-tetramethyl-2,5,6,7,7a,7b-hexahydro-1aH-cyclopropa[e]azulen-3-one.
Chemical Property Profile of Squamulosone
Property Insights of Squamulosone
The XLogP value of 3.1 indicates that Squamulosone is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. With a topological polar surface area (TPSA) of 17.1 Ų, Squamulosone exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, Squamulosone 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 Squamulosone?
The CAS number of Squamulosone is 34413-94-0.
What is the molecular formula of Squamulosone?
The molecular formula of Squamulosone is C15H22O.
What is the molecular weight of Squamulosone?
The molecular weight of Squamulosone is 218.17 g/mol.
Where can I buy Squamulosone?
You can request a quote for Squamulosone directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for Squamulosone?
Yes, KEHONG BIO provides custom synthesis services for Squamulosone and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.