1-(Butylthio)-3-isopropoxy-2-propanol
TL;DR: 1-(Butylthio)-3-isopropoxy-2-propanol (CAS 101683-89-0) is a chemical compound with molecular formula C10H22O2S and molecular weight 206.13 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
1-butylsulfanyl-3-propan-2-yloxypropan-2-ol
Also Known As: 1-(Butylthio)-3-isopropoxy-2-propanol, 1-(butylthio)-3-isopropoxypropan-2-ol, BIM-0018894.P001, 1-butylsulfanyl-3-propan-2-yloxypropan-2-ol, J2.302.550G
| Molecular Formula | C10H22O2S |
|---|---|
| Molecular Weight | 206.13 g/mol |
| LogP | 2.3056 |
| Topological Polar Surface Area | 29.46 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 3 |
| Rotatable Bonds | 8 |
| Exact Mass | 206.13405 |
| Heavy Atoms | 13 |
| Complexity | 107.09787 |
Chemical Identifiers
| CAS Number | 101683-89-0 |
|---|---|
| SMILES | CCCCSCC(COC(C)C)O |
Product Overview
1-(Butylthio)-3-isopropoxy-2-propanol (CAS 101683-89-0), with molecular formula C10H22O2S and molecular weight 206.13 g/mol. IUPAC: 1-butylsulfanyl-3-propan-2-yloxypropan-2-ol.
Chemical Property Profile of 1-(Butylthio)-3-isopropoxy-2-propanol
Property Insights of 1-(Butylthio)-3-isopropoxy-2-propanol
The XLogP value of 2.3056 suggests moderate lipophilicity, balancing water solubility and membrane permeability for 1-(Butylthio)-3-isopropoxy-2-propanol. With a topological polar surface area (TPSA) of 29.46 Ų, 1-(Butylthio)-3-isopropoxy-2-propanol exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, 1-(Butylthio)-3-isopropoxy-2-propanol has 1 hydrogen bond donor(s) and 3 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 1-(Butylthio)-3-isopropoxy-2-propanol?
The CAS number of 1-(Butylthio)-3-isopropoxy-2-propanol is 101683-89-0.
What is the molecular formula of 1-(Butylthio)-3-isopropoxy-2-propanol?
The molecular formula of 1-(Butylthio)-3-isopropoxy-2-propanol is C10H22O2S.
What is the molecular weight of 1-(Butylthio)-3-isopropoxy-2-propanol?
The molecular weight of 1-(Butylthio)-3-isopropoxy-2-propanol is 206.13 g/mol.
Where can I buy 1-(Butylthio)-3-isopropoxy-2-propanol?
You can request a quote for 1-(Butylthio)-3-isopropoxy-2-propanol directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 1-(Butylthio)-3-isopropoxy-2-propanol?
Yes, KEHONG BIO provides custom synthesis services for 1-(Butylthio)-3-isopropoxy-2-propanol and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.