Sulfide, neopentyl phenyl
TL;DR: Sulfide, neopentyl phenyl (CAS 7210-80-2) is a chemical compound with molecular formula C11H16S and molecular weight 180.10 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
2,2-dimethylpropylsulfanylbenzene
Also Known As: Sulfide, neopentyl phenyl, Neopentyl phenyl sulfide, Neopentyl phenylsulfide, Neopentylphenyl sulfide, NEOPENTYLPHENYLSULFIDE
| Molecular Formula | C11H16S |
|---|---|
| Molecular Weight | 180.10 g/mol |
| LogP | 4.6 |
| Topological Polar Surface Area | 25.3 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 1 |
| Rotatable Bonds | 3 |
| Exact Mass | 180.09727 |
| Heavy Atoms | 12 |
| Complexity | 117.0 |
Chemical Identifiers
| CAS Number | 7210-80-2 |
|---|---|
| SMILES | CC(C)(C)CSC1=CC=CC=C1 |
| InChIKey | OGILWELMFMDAJR-UHFFFAOYSA-N |
Patent-Derived Application Labels
Derived from 4 IPC patent classification(s) across the SureChEMBL global patent database.
Product Overview
Sulfide, neopentyl phenyl (CAS 7210-80-2), with molecular formula C11H16S and molecular weight 180.10 g/mol. IUPAC: 2,2-dimethylpropylsulfanylbenzene.
Chemical Property Profile of Sulfide, neopentyl phenyl
Property Insights of Sulfide, neopentyl phenyl
The XLogP value of 4.6 indicates that Sulfide, neopentyl phenyl is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. With a topological polar surface area (TPSA) of 25.3 Ų, Sulfide, neopentyl phenyl exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, Sulfide, neopentyl phenyl has 0 hydrogen bond donor(s) and 1 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 Sulfide, neopentyl phenyl?
The CAS number of Sulfide, neopentyl phenyl is 7210-80-2.
What is the molecular formula of Sulfide, neopentyl phenyl?
The molecular formula of Sulfide, neopentyl phenyl is C11H16S.
What is the molecular weight of Sulfide, neopentyl phenyl?
The molecular weight of Sulfide, neopentyl phenyl is 180.10 g/mol.
Where can I buy Sulfide, neopentyl phenyl?
You can request a quote for Sulfide, neopentyl phenyl directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for Sulfide, neopentyl phenyl?
Yes, KEHONG BIO provides custom synthesis services for Sulfide, neopentyl phenyl and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.