3-氯-3-甲基-5-苯基氧杂环戊烷-2-酮
TL;DR: 3-氯-3-甲基-5-苯基氧杂环戊烷-2-酮 (CAS 15121-77-4) is a chemical compound with molecular formula C11H11ClO2 and molecular weight 210.04 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
3-氯-3-甲基-5-苯基氧杂环戊烷-2-酮
3-chloro-3-methyl-5-phenyloxolan-2-one
Also Known As: 3-chloro-3-methyl-5-phenyloxolan-2-one, 3-Chlorodihydro-3-methyl-5-phenylfuran-2(3H)-one, 3-chloro-3-methyl-5-phenyldihydrofuran-2(3h)-one, 2(3H)-Furanone,3-chlorodihydro-3-methyl-5-phenyl-, 3-Chloro-4,5-dihydro-3-methyl-5-phenyl-2(3H)-furanone
| Molecular Formula | C11H11ClO2 |
|---|---|
| Molecular Weight | 210.04 g/mol |
| LogP | 2.6 |
| Topological Polar Surface Area | 26.3 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 2 |
| Rotatable Bonds | 1 |
| Exact Mass | 210.04475 |
| Heavy Atoms | 14 |
| Complexity | 235.0 |
Chemical Identifiers
| CAS Number | 15121-77-4 |
|---|---|
| SMILES | CC1(CC(OC1=O)C2=CC=CC=C2)Cl |
| InChIKey | IVPWPXOKZYCQNZ-UHFFFAOYSA-N |
Product Overview
3-氯-3-甲基-5-苯基氧杂环戊烷-2-酮 (CAS 15121-77-4), with molecular formula C11H11ClO2 and molecular weight 210.04 g/mol. IUPAC: 3-chloro-3-methyl-5-phenyloxolan-2-one.
Chemical Property Profile of 3-氯-3-甲基-5-苯基氧杂环戊烷-2-酮
Property Insights of 3-氯-3-甲基-5-苯基氧杂环戊烷-2-酮
The XLogP value of 2.6 suggests moderate lipophilicity, balancing water solubility and membrane permeability for 3-氯-3-甲基-5-苯基氧杂环戊烷-2-酮. With a topological polar surface area (TPSA) of 26.3 Ų, 3-氯-3-甲基-5-苯基氧杂环戊烷-2-酮 exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, 3-氯-3-甲基-5-苯基氧杂环戊烷-2-酮 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 3-氯-3-甲基-5-苯基氧杂环戊烷-2-酮?
The CAS number of 3-氯-3-甲基-5-苯基氧杂环戊烷-2-酮 is 15121-77-4.
What is the molecular formula of 3-氯-3-甲基-5-苯基氧杂环戊烷-2-酮?
The molecular formula of 3-氯-3-甲基-5-苯基氧杂环戊烷-2-酮 is C11H11ClO2.
What is the molecular weight of 3-氯-3-甲基-5-苯基氧杂环戊烷-2-酮?
The molecular weight of 3-氯-3-甲基-5-苯基氧杂环戊烷-2-酮 is 210.04 g/mol.
Where can I buy 3-氯-3-甲基-5-苯基氧杂环戊烷-2-酮?
You can request a quote for 3-氯-3-甲基-5-苯基氧杂环戊烷-2-酮 directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 3-氯-3-甲基-5-苯基氧杂环戊烷-2-酮?
Yes, KEHONG BIO provides custom synthesis services for 3-氯-3-甲基-5-苯基氧杂环戊烷-2-酮 and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.