![1,3-Dioxolane, 2-methyl-2-[3-(phenylthio)propyl]- structure](/static/products/976/97600-68-5.png)
1,3-Dioxolane, 2-methyl-2-[3-(phenylthio)propyl]-
TL;DR: 1,3-Dioxolane, 2-methyl-2-[3-(phenylthio)propyl]- (CAS 97600-68-5) is a chemical compound with molecular formula C13H18O2S and molecular weight 238.10 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
2-methyl-2-(3-phenylsulfanylpropyl)-1,3-dioxolane
Also Known As: 1,3-Dioxolane, 2-methyl-2-[3-(phenylthio)propyl]-, 2-methyl-2-(3-phenylsulfanylpropyl)-1,3-dioxolane, 1,3-Dioxolane,2-methyl-2-[3-(phenylthio)propyl], 2-METHYL-2-[3-(PHENYLSULFANYL)PROPYL]-1,3-DIOXOLANE
| Molecular Formula | C13H18O2S |
|---|---|
| Molecular Weight | 238.10 g/mol |
| LogP | 3.3219 |
| Topological Polar Surface Area | 18.46 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 3 |
| Rotatable Bonds | 5 |
| Exact Mass | 238.10275 |
| Heavy Atoms | 16 |
| Complexity | 306.96844 |
Chemical Identifiers
| CAS Number | 97600-68-5 |
|---|---|
| SMILES | CC1(OCCO1)CCCSC2=CC=CC=C2 |
Product Overview
1,3-Dioxolane, 2-methyl-2-[3-(phenylthio)propyl]- (CAS 97600-68-5), with molecular formula C13H18O2S and molecular weight 238.10 g/mol. IUPAC: 2-methyl-2-(3-phenylsulfanylpropyl)-1,3-dioxolane.
Chemical Property Profile of 1,3-Dioxolane, 2-methyl-2-[3-(phenylthio)propyl]-
Property Insights of 1,3-Dioxolane, 2-methyl-2-[3-(phenylthio)propyl]-
The XLogP value of 3.3219 indicates that 1,3-Dioxolane, 2-methyl-2-[3-(phenylthio)propyl]- is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. With a topological polar surface area (TPSA) of 18.46 Ų, 1,3-Dioxolane, 2-methyl-2-[3-(phenylthio)propyl]- exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, 1,3-Dioxolane, 2-methyl-2-[3-(phenylthio)propyl]- 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-Dioxolane, 2-methyl-2-[3-(phenylthio)propyl]-?
The CAS number of 1,3-Dioxolane, 2-methyl-2-[3-(phenylthio)propyl]- is 97600-68-5.
What is the molecular formula of 1,3-Dioxolane, 2-methyl-2-[3-(phenylthio)propyl]-?
The molecular formula of 1,3-Dioxolane, 2-methyl-2-[3-(phenylthio)propyl]- is C13H18O2S.
What is the molecular weight of 1,3-Dioxolane, 2-methyl-2-[3-(phenylthio)propyl]-?
The molecular weight of 1,3-Dioxolane, 2-methyl-2-[3-(phenylthio)propyl]- is 238.10 g/mol.
Where can I buy 1,3-Dioxolane, 2-methyl-2-[3-(phenylthio)propyl]-?
You can request a quote for 1,3-Dioxolane, 2-methyl-2-[3-(phenylthio)propyl]- 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-methyl-2-[3-(phenylthio)propyl]-?
Yes, KEHONG BIO provides custom synthesis services for 1,3-Dioxolane, 2-methyl-2-[3-(phenylthio)propyl]- and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.