4-Bromophenyl 3-chloropropyl sulfide
TL;DR: 4-Bromophenyl 3-chloropropyl sulfide (CAS 16181-12-7) is a chemical compound with molecular formula C9H10BrClS and molecular weight 263.94 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
1-bromo-4-(3-chloropropylsulfanyl)benzene
Also Known As: (4-Bromophenyl)(3-chloropropyl)sulfane, 1-bromo-4-(3-chloropropylsulfanyl)benzene, 4-BROMOPHENYL 3-CHLOROPROPYL SULFIDE, 1-BROMO-4-[(3-CHLOROPROPYL)SULFANYL]BENZENE, Benzene, 1-bromo-4-[(3-chloropropyl)thio]-
| Molecular Formula | C9H10BrClS |
|---|---|
| Molecular Weight | 263.94 g/mol |
| LogP | 4.1701 |
| Topological Polar Surface Area | 0.0 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 1 |
| Rotatable Bonds | 4 |
| Exact Mass | 263.9375 |
| Heavy Atoms | 12 |
| Complexity | 222.47507 |
Chemical Identifiers
| CAS Number | 16181-12-7 |
|---|---|
| SMILES | C1=CC(=CC=C1SCCCCl)Br |
Product Overview
4-Bromophenyl 3-chloropropyl sulfide (CAS 16181-12-7), with molecular formula C9H10BrClS and molecular weight 263.94 g/mol. IUPAC: 1-bromo-4-(3-chloropropylsulfanyl)benzene.
Chemical Property Profile of 4-Bromophenyl 3-chloropropyl sulfide
Property Insights of 4-Bromophenyl 3-chloropropyl sulfide
The XLogP value of 4.1701 indicates that 4-Bromophenyl 3-chloropropyl 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, 4-Bromophenyl 3-chloropropyl sulfide exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, 4-Bromophenyl 3-chloropropyl 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 4-Bromophenyl 3-chloropropyl sulfide?
The CAS number of 4-Bromophenyl 3-chloropropyl sulfide is 16181-12-7.
What is the molecular formula of 4-Bromophenyl 3-chloropropyl sulfide?
The molecular formula of 4-Bromophenyl 3-chloropropyl sulfide is C9H10BrClS.
What is the molecular weight of 4-Bromophenyl 3-chloropropyl sulfide?
The molecular weight of 4-Bromophenyl 3-chloropropyl sulfide is 263.94 g/mol.
Where can I buy 4-Bromophenyl 3-chloropropyl sulfide?
You can request a quote for 4-Bromophenyl 3-chloropropyl sulfide directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 4-Bromophenyl 3-chloropropyl sulfide?
Yes, KEHONG BIO provides custom synthesis services for 4-Bromophenyl 3-chloropropyl sulfide and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.