3-(Benzylsulfanyl)propan-1-ol
TL;DR: 3-(Benzylsulfanyl)propan-1-ol (CAS 26902-03-4) is a chemical compound with molecular formula C10H14OS and molecular weight 182.08 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
3-benzylsulfanylpropan-1-ol
Also Known As: 3-(Benzylsulfanyl)propan-1-ol, 3-benzylsulfanylpropan-1-ol, 3-(Benzylthio)-1-propanol, 3-[(Phenylmethyl)thio]-1-propanol, 3-(BENZYLSULFANYL)-1-PROPANOL
| Molecular Formula | C10H14OS |
|---|---|
| Molecular Weight | 182.08 g/mol |
| LogP | 2.0 |
| Topological Polar Surface Area | 45.5 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 2 |
| Rotatable Bonds | 5 |
| Exact Mass | 182.07654 |
| Heavy Atoms | 12 |
| Complexity | 100.0 |
Chemical Identifiers
| CAS Number | 26902-03-4 |
|---|---|
| SMILES | C1=CC=C(C=C1)CSCCCO |
| InChIKey | JXKPOLNVTYFXSN-UHFFFAOYSA-N |
Patent-Derived Application Labels
Derived from 5 IPC patent classification(s) across the SureChEMBL global patent database.
Product Overview
3-(Benzylsulfanyl)propan-1-ol (CAS 26902-03-4), with molecular formula C10H14OS and molecular weight 182.08 g/mol. IUPAC: 3-benzylsulfanylpropan-1-ol.
Chemical Property Profile of 3-(Benzylsulfanyl)propan-1-ol
Property Insights of 3-(Benzylsulfanyl)propan-1-ol
The XLogP value of 2.0 suggests moderate lipophilicity, balancing water solubility and membrane permeability for 3-(Benzylsulfanyl)propan-1-ol. With a topological polar surface area (TPSA) of 45.5 Ų, 3-(Benzylsulfanyl)propan-1-ol exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, 3-(Benzylsulfanyl)propan-1-ol has 1 hydrogen bond donor(s) and 2 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-(Benzylsulfanyl)propan-1-ol?
The CAS number of 3-(Benzylsulfanyl)propan-1-ol is 26902-03-4.
What is the molecular formula of 3-(Benzylsulfanyl)propan-1-ol?
The molecular formula of 3-(Benzylsulfanyl)propan-1-ol is C10H14OS.
What is the molecular weight of 3-(Benzylsulfanyl)propan-1-ol?
The molecular weight of 3-(Benzylsulfanyl)propan-1-ol is 182.08 g/mol.
Where can I buy 3-(Benzylsulfanyl)propan-1-ol?
You can request a quote for 3-(Benzylsulfanyl)propan-1-ol directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 3-(Benzylsulfanyl)propan-1-ol?
Yes, KEHONG BIO provides custom synthesis services for 3-(Benzylsulfanyl)propan-1-ol and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.