![Benzene, 1-methoxy-3-[(phenylthio)methyl]- structure](/static/products/1395/139599-68-1.webp)
Benzene, 1-methoxy-3-[(phenylthio)methyl]-
TL;DR: Benzene, 1-methoxy-3-[(phenylthio)methyl]- (CAS 139599-68-1) is a chemical compound with molecular formula C14H14OS and molecular weight 230.07654 g/mol, supplied by CoreyChem (Career Henan Chemical Co., Ltd.) with ISO-certified quality and global shipping.
1-methoxy-3-(phenylsulfanylmethyl)benzene
Also Known As: Phenyl 3-methoxybenzyl sulfide, Benzene, 1-methoxy-3-[(phenylthio)methyl]-, 1-methoxy-3-(phenylsulfanylmethyl)benzene, 3-methoxy-1-(phenylthiomethyl)benzene, 1-METHOXY-3-[(PHENYLSULFANYL)METHYL]BENZENE
Technical Specifications
| Molecular Formula | C14H14OS |
| Molecular Weight | 230.07654 g/mol |
| XLogP | 3.8 |
| Topological Polar Surface Area (TPSA) | 34.5 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 2 |
| Rotatable Bonds | 4 |
| Exact Mass | 230.07654 Da |
| Heavy Atoms | 16 |
| Complexity | 189.0 |
| SMILES | COC1=CC=CC(=C1)CSC2=CC=CC=C2 |
| InChIKey | OZIYBVAKBOSPHQ-UHFFFAOYSA-N |
Chemical Property Profile of Benzene, 1-methoxy-3-[(phenylthio)methyl]-
Property Insights of Benzene, 1-methoxy-3-[(phenylthio)methyl]-
The XLogP value of 3.8 indicates that Benzene, 1-methoxy-3-[(phenylthio)methyl]- is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. With a topological polar surface area (TPSA) of 34.5 Ų, Benzene, 1-methoxy-3-[(phenylthio)methyl]- exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, Benzene, 1-methoxy-3-[(phenylthio)methyl]- 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
What is the CAS number of Benzene, 1-methoxy-3-[(phenylthio)methyl]-?
The CAS number of Benzene, 1-methoxy-3-[(phenylthio)methyl]- is 139599-68-1.
What is the molecular formula of Benzene, 1-methoxy-3-[(phenylthio)methyl]-?
The molecular formula of Benzene, 1-methoxy-3-[(phenylthio)methyl]- is C14H14OS.
What is the molecular weight of Benzene, 1-methoxy-3-[(phenylthio)methyl]-?
The molecular weight of Benzene, 1-methoxy-3-[(phenylthio)methyl]- is 230.07654 g/mol.
Where can I buy Benzene, 1-methoxy-3-[(phenylthio)methyl]-?
You can request a quote for Benzene, 1-methoxy-3-[(phenylthio)methyl]- directly from CoreyChem. Contact us or email [email protected] for pricing and availability.
Does CoreyChem offer custom synthesis for Benzene, 1-methoxy-3-[(phenylthio)methyl]-?
Yes, CoreyChem provides custom synthesis services for Benzene, 1-methoxy-3-[(phenylthio)methyl]- and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.