3-Bromopropyl phenyl sulfide
TL;DR: 3-Bromopropyl phenyl sulfide (CAS 3238-98-0) is a chemical compound with molecular formula C9H11BrS and molecular weight 229.98 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
3-bromopropylsulfanylbenzene
Also Known As: 3-bromopropyl phenyl sulfide, 3-Bromopropylthiobenzene, 3-Bromopropylphenyl sulfide, 3-bromopropylsulfanylbenzene, 3-Bromopropylphenylsulfide
| Molecular Formula | C9H11BrS |
|---|---|
| Molecular Weight | 229.98 g/mol |
| LogP | 3.5637 |
| Topological Polar Surface Area | 0.0 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 1 |
| Rotatable Bonds | 4 |
| Exact Mass | 229.97649 |
| Heavy Atoms | 11 |
| Complexity | 186.01404 |
Chemical Identifiers
| CAS Number | 3238-98-0 |
|---|---|
| SMILES | C1=CC=C(C=C1)SCCCBr |
Product Overview
3-Bromopropyl phenyl sulfide (CAS 3238-98-0), with molecular formula C9H11BrS and molecular weight 229.98 g/mol. IUPAC: 3-bromopropylsulfanylbenzene.
Chemical Property Profile of 3-Bromopropyl phenyl sulfide
Property Insights of 3-Bromopropyl phenyl sulfide
The XLogP value of 3.5637 indicates that 3-Bromopropyl phenyl sulfide is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. With a topological polar surface area (TPSA) of 0.0 Ų, 3-Bromopropyl phenyl sulfide exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, 3-Bromopropyl phenyl sulfide 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 3-Bromopropyl phenyl sulfide?
The CAS number of 3-Bromopropyl phenyl sulfide is 3238-98-0.
What is the molecular formula of 3-Bromopropyl phenyl sulfide?
The molecular formula of 3-Bromopropyl phenyl sulfide is C9H11BrS.
What is the molecular weight of 3-Bromopropyl phenyl sulfide?
The molecular weight of 3-Bromopropyl phenyl sulfide is 229.98 g/mol.
Where can I buy 3-Bromopropyl phenyl sulfide?
You can request a quote for 3-Bromopropyl phenyl sulfide directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 3-Bromopropyl phenyl sulfide?
Yes, KEHONG BIO provides custom synthesis services for 3-Bromopropyl phenyl sulfide and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.