Cycloheptanone, 3-(2-oxopropyl)-
TL;DR: Cycloheptanone, 3-(2-oxopropyl)- (CAS 66921-76-4) is a chemical compound with molecular formula C10H16O2 and molecular weight 168.12 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
3-(2-oxopropyl)cycloheptan-1-one
Also Known As: 3-Acetonylcycloheptanone, 3-(2-oxopropyl)cycloheptan-1-one, Cycloheptanone, 3-(2-oxopropyl)-, 3-(2-Oxopropyl)cycloheptanone
| Molecular Formula | C10H16O2 |
|---|---|
| Molecular Weight | 168.12 g/mol |
| LogP | 1.0 |
| Topological Polar Surface Area | 34.1 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 2 |
| Rotatable Bonds | 2 |
| Exact Mass | 168.11504 |
| Heavy Atoms | 12 |
| Complexity | 184.0 |
Chemical Identifiers
| CAS Number | 66921-76-4 |
|---|---|
| SMILES | CC(=O)CC1CCCCC(=O)C1 |
| InChIKey | BOELKTAUJTUZPI-UHFFFAOYSA-N |
Product Overview
Cycloheptanone, 3-(2-oxopropyl)- (CAS 66921-76-4), with molecular formula C10H16O2 and molecular weight 168.12 g/mol. IUPAC: 3-(2-oxopropyl)cycloheptan-1-one.
Chemical Property Profile of Cycloheptanone, 3-(2-oxopropyl)-
Property Insights of Cycloheptanone, 3-(2-oxopropyl)-
The XLogP value of 1.0 suggests moderate lipophilicity, balancing water solubility and membrane permeability for Cycloheptanone, 3-(2-oxopropyl)-. With a topological polar surface area (TPSA) of 34.1 Ų, Cycloheptanone, 3-(2-oxopropyl)- exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, Cycloheptanone, 3-(2-oxopropyl)- 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 Cycloheptanone, 3-(2-oxopropyl)-?
The CAS number of Cycloheptanone, 3-(2-oxopropyl)- is 66921-76-4.
What is the molecular formula of Cycloheptanone, 3-(2-oxopropyl)-?
The molecular formula of Cycloheptanone, 3-(2-oxopropyl)- is C10H16O2.
What is the molecular weight of Cycloheptanone, 3-(2-oxopropyl)-?
The molecular weight of Cycloheptanone, 3-(2-oxopropyl)- is 168.12 g/mol.
Where can I buy Cycloheptanone, 3-(2-oxopropyl)-?
You can request a quote for Cycloheptanone, 3-(2-oxopropyl)- directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for Cycloheptanone, 3-(2-oxopropyl)-?
Yes, KEHONG BIO provides custom synthesis services for Cycloheptanone, 3-(2-oxopropyl)- and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.