1,3-Dioxolan-2-one, 4,4-dimethyl-5-methylene-
TL;DR: 1,3-Dioxolan-2-one, 4,4-dimethyl-5-methylene- (CAS 4437-80-3) is a chemical compound with molecular formula C6H8O3 and molecular weight 128.05 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
4,4-dimethyl-5-methylidene-1,3-dioxolan-2-one
Also Known As: 4,4-dimethyl-5-methylidene-1,3-dioxolan-2-one, 4,4-Dimethyl-5-methylene-1,3-dioxolan-2-one, ZERO/000566, 1,3-Dioxolan-2-one, 4,4-dimethyl-5-methylene-, 4,4-DIMETHYL-5-METHYLEN-1,3-DIOXOLANE-2-ONE
| Molecular Formula | C6H8O3 |
|---|---|
| Molecular Weight | 128.05 g/mol |
| LogP | 1.2 |
| Topological Polar Surface Area | 35.5 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 3 |
| Rotatable Bonds | 0 |
| Exact Mass | 128.04735 |
| Heavy Atoms | 9 |
| Complexity | 169.0 |
Chemical Identifiers
| CAS Number | 4437-80-3 |
|---|---|
| SMILES | CC1(C(=C)OC(=O)O1)C |
| InChIKey | WUGCPRNXGBZRMC-UHFFFAOYSA-N |
Patent-Derived Application Labels
Derived from 3 IPC patent classification(s) across the SureChEMBL global patent database.
Product Overview
1,3-Dioxolan-2-one, 4,4-dimethyl-5-methylene- (CAS 4437-80-3), with molecular formula C6H8O3 and molecular weight 128.05 g/mol. IUPAC: 4,4-dimethyl-5-methylidene-1,3-dioxolan-2-one.
Chemical Property Profile of 1,3-Dioxolan-2-one, 4,4-dimethyl-5-methylene-
Property Insights of 1,3-Dioxolan-2-one, 4,4-dimethyl-5-methylene-
The XLogP value of 1.2 suggests moderate lipophilicity, balancing water solubility and membrane permeability for 1,3-Dioxolan-2-one, 4,4-dimethyl-5-methylene-. With a topological polar surface area (TPSA) of 35.5 Ų, 1,3-Dioxolan-2-one, 4,4-dimethyl-5-methylene- exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, 1,3-Dioxolan-2-one, 4,4-dimethyl-5-methylene- has 0 hydrogen bond donor(s) and 3 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 1,3-Dioxolan-2-one, 4,4-dimethyl-5-methylene-?
The CAS number of 1,3-Dioxolan-2-one, 4,4-dimethyl-5-methylene- is 4437-80-3.
What is the molecular formula of 1,3-Dioxolan-2-one, 4,4-dimethyl-5-methylene-?
The molecular formula of 1,3-Dioxolan-2-one, 4,4-dimethyl-5-methylene- is C6H8O3.
What is the molecular weight of 1,3-Dioxolan-2-one, 4,4-dimethyl-5-methylene-?
The molecular weight of 1,3-Dioxolan-2-one, 4,4-dimethyl-5-methylene- is 128.05 g/mol.
Where can I buy 1,3-Dioxolan-2-one, 4,4-dimethyl-5-methylene-?
You can request a quote for 1,3-Dioxolan-2-one, 4,4-dimethyl-5-methylene- directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 1,3-Dioxolan-2-one, 4,4-dimethyl-5-methylene-?
Yes, KEHONG BIO provides custom synthesis services for 1,3-Dioxolan-2-one, 4,4-dimethyl-5-methylene- and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.