racemic-9-Pupukeanone
TL;DR: racemic-9-Pupukeanone (CAS 70329-89-4) 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.
(1R,3R,5R,6S,7S)-1,3-dimethyl-5-propan-2-yltricyclo[4.3.1.03,7]decan-9-one
Also Known As: racemic-9-Pupukeanone, (+/-)-9-Pupukeanone, 3-Isopropyl-1,5-dimethyl-octahydro-1,5-methano-inden-6-one, 1,5-Dimethyl-3-(propan-2-yl)octahydro-6H-1,5-methanoinden-6-one, (1R,3R,3aS,5R,7aS)-1,5-Dimethyl-3-(propan-2-yl)octahydro-6H-1,5-methanoinden-6-one
| Molecular Formula | C15H24O |
|---|---|
| Molecular Weight | 220.18 g/mol |
| LogP | 3.6 |
| Topological Polar Surface Area | 17.1 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 1 |
| Rotatable Bonds | 1 |
| Exact Mass | 220.18271 |
| Heavy Atoms | 16 |
| Complexity | 345.0 |
Chemical Identifiers
| CAS Number | 70329-89-4 |
|---|---|
| SMILES | CC(C)[C@H]1C[C@@]2(C[C@]3(C[C@@H]1[C@@H]2CC3=O)C)C |
| InChIKey | FHGVQISYQRBFTF-CYHVGBIXSA-N |
Product Overview
racemic-9-Pupukeanone (CAS 70329-89-4), with molecular formula C15H24O and molecular weight 220.18 g/mol. IUPAC: (1R,3R,5R,6S,7S)-1,3-dimethyl-5-propan-2-yltricyclo[4.3.1.03,7]decan-9-one.
Chemical Property Profile of racemic-9-Pupukeanone
Property Insights of racemic-9-Pupukeanone
The XLogP value of 3.6 indicates that racemic-9-Pupukeanone is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. With a topological polar surface area (TPSA) of 17.1 Ų, racemic-9-Pupukeanone exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, racemic-9-Pupukeanone 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 racemic-9-Pupukeanone?
The CAS number of racemic-9-Pupukeanone is 70329-89-4.
What is the molecular formula of racemic-9-Pupukeanone?
The molecular formula of racemic-9-Pupukeanone is C15H24O.
What is the molecular weight of racemic-9-Pupukeanone?
The molecular weight of racemic-9-Pupukeanone is 220.18 g/mol.
Where can I buy racemic-9-Pupukeanone?
You can request a quote for racemic-9-Pupukeanone directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for racemic-9-Pupukeanone?
Yes, KEHONG BIO provides custom synthesis services for racemic-9-Pupukeanone and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.