1,3-Dioxolane, 2,2-dimethyl-4,5-bis(methylene)-
TL;DR: 1,3-Dioxolane, 2,2-dimethyl-4,5-bis(methylene)- (CAS 70517-23-6) is a chemical compound with molecular formula C7H10O2 and molecular weight 126.07 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
2,2-dimethyl-4,5-dimethylidene-1,3-dioxolane
Also Known As: 1,3-Dioxolane, 2,2-dimethyl-4,5-bis(methylene)-, 2,2-dimethyl-4,5-dimethylidene-1,3-dioxolane, 1,3-Dioxolane,2,2-dimethyl-4,5-bis(methylene)-, 1,3-Dioxolane,2,2-dimethyl-4,5-bis -, RefChem:218912
| Molecular Formula | C7H10O2 |
|---|---|
| Molecular Weight | 126.07 g/mol |
| LogP | 1.9 |
| Topological Polar Surface Area | 18.5 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 2 |
| Rotatable Bonds | 0 |
| Exact Mass | 126.06808 |
| Heavy Atoms | 9 |
| Complexity | 150.0 |
Chemical Identifiers
| CAS Number | 70517-23-6 |
|---|---|
| SMILES | CC1(OC(=C)C(=C)O1)C |
| InChIKey | BAWTXMMJEOOVHY-UHFFFAOYSA-N |
Patent-Derived Application Labels
Derived from 2 IPC patent classification(s) across the SureChEMBL global patent database.
Product Overview
1,3-Dioxolane, 2,2-dimethyl-4,5-bis(methylene)- (CAS 70517-23-6), with molecular formula C7H10O2 and molecular weight 126.07 g/mol. IUPAC: 2,2-dimethyl-4,5-dimethylidene-1,3-dioxolane.
Chemical Property Profile of 1,3-Dioxolane, 2,2-dimethyl-4,5-bis(methylene)-
Property Insights of 1,3-Dioxolane, 2,2-dimethyl-4,5-bis(methylene)-
The XLogP value of 1.9 suggests moderate lipophilicity, balancing water solubility and membrane permeability for 1,3-Dioxolane, 2,2-dimethyl-4,5-bis(methylene)-. With a topological polar surface area (TPSA) of 18.5 Ų, 1,3-Dioxolane, 2,2-dimethyl-4,5-bis(methylene)- exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, 1,3-Dioxolane, 2,2-dimethyl-4,5-bis(methylene)- 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 1,3-Dioxolane, 2,2-dimethyl-4,5-bis(methylene)-?
The CAS number of 1,3-Dioxolane, 2,2-dimethyl-4,5-bis(methylene)- is 70517-23-6.
What is the molecular formula of 1,3-Dioxolane, 2,2-dimethyl-4,5-bis(methylene)-?
The molecular formula of 1,3-Dioxolane, 2,2-dimethyl-4,5-bis(methylene)- is C7H10O2.
What is the molecular weight of 1,3-Dioxolane, 2,2-dimethyl-4,5-bis(methylene)-?
The molecular weight of 1,3-Dioxolane, 2,2-dimethyl-4,5-bis(methylene)- is 126.07 g/mol.
Where can I buy 1,3-Dioxolane, 2,2-dimethyl-4,5-bis(methylene)-?
You can request a quote for 1,3-Dioxolane, 2,2-dimethyl-4,5-bis(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-Dioxolane, 2,2-dimethyl-4,5-bis(methylene)-?
Yes, KEHONG BIO provides custom synthesis services for 1,3-Dioxolane, 2,2-dimethyl-4,5-bis(methylene)- and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.