![3-[(Acetyl) (methoxycarbonyl)methyl]cyclopentanone structure](/static/products/724/724774-84-9.png)
3-[(Acetyl) (methoxycarbonyl)methyl]cyclopentanone
TL;DR: 3-[(Acetyl) (methoxycarbonyl)methyl]cyclopentanone (CAS 724774-84-9) is a chemical compound with molecular formula C10H14O4 and molecular weight 198.09 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
methyl 3-oxo-2-(3-oxocyclopentyl)butanoate
Also Known As: Methyl 3-oxo-2-(3-oxocyclopentyl)butanoate, 3-[(acetyl) (methoxycarbonyl)methyl]cyclopentanone, Cyclopentaneaceticacid,-alpha--acetyl-3-oxo-,methylester, Cyclopentaneacetic acid, -alpha--acetyl-3-oxo-, methyl ester (9CI)
| Molecular Formula | C10H14O4 |
|---|---|
| Molecular Weight | 198.09 g/mol |
| LogP | 0.7338 |
| Topological Polar Surface Area | 60.44 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 4 |
| Rotatable Bonds | 3 |
| Exact Mass | 198.0892 |
| Heavy Atoms | 14 |
| Complexity | 269.29556 |
Chemical Identifiers
| CAS Number | 724774-84-9 |
|---|---|
| SMILES | CC(=O)C(C1CCC(=O)C1)C(=O)OC |
Product Overview
3-[(Acetyl) (methoxycarbonyl)methyl]cyclopentanone (CAS 724774-84-9), with molecular formula C10H14O4 and molecular weight 198.09 g/mol. IUPAC: methyl 3-oxo-2-(3-oxocyclopentyl)butanoate.
Chemical Property Profile of 3-[(Acetyl) (methoxycarbonyl)methyl]cyclopentanone
Property Insights of 3-[(Acetyl) (methoxycarbonyl)methyl]cyclopentanone
The XLogP value of 0.7338 suggests moderate lipophilicity, balancing water solubility and membrane permeability for 3-[(Acetyl) (methoxycarbonyl)methyl]cyclopentanone. The TPSA of 60.44 Ų falls within the moderate polarity range, balancing permeability and solubility for 3-[(Acetyl) (methoxycarbonyl)methyl]cyclopentanone. Following Lipinski's Rule of Five, 3-[(Acetyl) (methoxycarbonyl)methyl]cyclopentanone has 0 hydrogen bond donor(s) and 4 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 3-[(Acetyl) (methoxycarbonyl)methyl]cyclopentanone?
The CAS number of 3-[(Acetyl) (methoxycarbonyl)methyl]cyclopentanone is 724774-84-9.
What is the molecular formula of 3-[(Acetyl) (methoxycarbonyl)methyl]cyclopentanone?
The molecular formula of 3-[(Acetyl) (methoxycarbonyl)methyl]cyclopentanone is C10H14O4.
What is the molecular weight of 3-[(Acetyl) (methoxycarbonyl)methyl]cyclopentanone?
The molecular weight of 3-[(Acetyl) (methoxycarbonyl)methyl]cyclopentanone is 198.09 g/mol.
Where can I buy 3-[(Acetyl) (methoxycarbonyl)methyl]cyclopentanone?
You can request a quote for 3-[(Acetyl) (methoxycarbonyl)methyl]cyclopentanone directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 3-[(Acetyl) (methoxycarbonyl)methyl]cyclopentanone?
Yes, KEHONG BIO provides custom synthesis services for 3-[(Acetyl) (methoxycarbonyl)methyl]cyclopentanone and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.