3-(4-Chlorophenyl)-5,5-dimethyl-4-methylene-2-oxazolidinone
TL;DR: 3-(4-Chlorophenyl)-5,5-dimethyl-4-methylene-2-oxazolidinone (CAS 55476-05-6) is a chemical compound with molecular formula C12H12ClNO2 and molecular weight 237.06 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
3-(4-chlorophenyl)-5,5-dimethyl-4-methylidene-1,3-oxazolidin-2-one
Also Known As: TimTec1_002725, 3-(4-Chlorophenyl)-5,5-dimethyl-4-methylene-1,3-oxazolidin-2-one, 3-(4-Chlorophenyl)-5,5-dimethyl-4-methylene-2-oxazolidinone, 3-(4-chlorophenyl)-5,5-dimethyl-4-methylidene-1,3-oxazolidin-2-one, J2.854.792G
| Molecular Formula | C12H12ClNO2 |
|---|---|
| Molecular Weight | 237.06 g/mol |
| LogP | 3.0 |
| Topological Polar Surface Area | 29.5 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 2 |
| Rotatable Bonds | 1 |
| Exact Mass | 237.05565 |
| Heavy Atoms | 16 |
| Complexity | 319.0 |
Chemical Identifiers
| CAS Number | 55476-05-6 |
|---|---|
| SMILES | CC1(C(=C)N(C(=O)O1)C2=CC=C(C=C2)Cl)C |
| InChIKey | BYFMZBBWOMBIJC-UHFFFAOYSA-N |
Product Overview
3-(4-Chlorophenyl)-5,5-dimethyl-4-methylene-2-oxazolidinone (CAS 55476-05-6), with molecular formula C12H12ClNO2 and molecular weight 237.06 g/mol. IUPAC: 3-(4-chlorophenyl)-5,5-dimethyl-4-methylidene-1,3-oxazolidin-2-one.
Chemical Property Profile of 3-(4-Chlorophenyl)-5,5-dimethyl-4-methylene-2-oxazolidinone
Property Insights of 3-(4-Chlorophenyl)-5,5-dimethyl-4-methylene-2-oxazolidinone
The XLogP value of 3.0 indicates that 3-(4-Chlorophenyl)-5,5-dimethyl-4-methylene-2-oxazolidinone is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. With a topological polar surface area (TPSA) of 29.5 Ų, 3-(4-Chlorophenyl)-5,5-dimethyl-4-methylene-2-oxazolidinone exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, 3-(4-Chlorophenyl)-5,5-dimethyl-4-methylene-2-oxazolidinone 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-(4-Chlorophenyl)-5,5-dimethyl-4-methylene-2-oxazolidinone?
The CAS number of 3-(4-Chlorophenyl)-5,5-dimethyl-4-methylene-2-oxazolidinone is 55476-05-6.
What is the molecular formula of 3-(4-Chlorophenyl)-5,5-dimethyl-4-methylene-2-oxazolidinone?
The molecular formula of 3-(4-Chlorophenyl)-5,5-dimethyl-4-methylene-2-oxazolidinone is C12H12ClNO2.
What is the molecular weight of 3-(4-Chlorophenyl)-5,5-dimethyl-4-methylene-2-oxazolidinone?
The molecular weight of 3-(4-Chlorophenyl)-5,5-dimethyl-4-methylene-2-oxazolidinone is 237.06 g/mol.
Where can I buy 3-(4-Chlorophenyl)-5,5-dimethyl-4-methylene-2-oxazolidinone?
You can request a quote for 3-(4-Chlorophenyl)-5,5-dimethyl-4-methylene-2-oxazolidinone directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 3-(4-Chlorophenyl)-5,5-dimethyl-4-methylene-2-oxazolidinone?
Yes, KEHONG BIO provides custom synthesis services for 3-(4-Chlorophenyl)-5,5-dimethyl-4-methylene-2-oxazolidinone and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.