(2S)-pentane-1,2-diol
TL;DR: (2S)-pentane-1,2-diol (CAS 29117-54-2) is a chemical compound with molecular formula C5H12O2 and molecular weight 104.08 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
(2S)-pentane-1,2-diol
Also Known As: (2S)-pentane-1,2-diol, (s)-pentane-1,2-diol, 1,2-Pentanediol, (2S)-, (S)-1,2-PENTANEDIOL, beta-Cyanopropiophenone
| Molecular Formula | C5H12O2 |
|---|---|
| Molecular Weight | 104.08 g/mol |
| LogP | 0.1397 |
| Topological Polar Surface Area | 40.46 Ų |
| Hydrogen Bond Donors | 2 |
| Hydrogen Bond Acceptors | 2 |
| Rotatable Bonds | 3 |
| Exact Mass | 104.08373 |
| Heavy Atoms | 7 |
| Complexity | 37.061394 |
Chemical Identifiers
| CAS Number | 29117-54-2 |
|---|---|
| SMILES | CCC[C@@H](CO)O |
Product Overview
(2S)-pentane-1,2-diol (CAS 29117-54-2), with molecular formula C5H12O2 and molecular weight 104.08 g/mol. IUPAC: (2S)-pentane-1,2-diol.
Chemical Property Profile of (2S)-pentane-1,2-diol
Property Insights of (2S)-pentane-1,2-diol
The XLogP value of 0.1397 suggests moderate lipophilicity, balancing water solubility and membrane permeability for (2S)-pentane-1,2-diol. With a topological polar surface area (TPSA) of 40.46 Ų, (2S)-pentane-1,2-diol exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, (2S)-pentane-1,2-diol has 2 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 (2S)-pentane-1,2-diol?
The CAS number of (2S)-pentane-1,2-diol is 29117-54-2.
What is the molecular formula of (2S)-pentane-1,2-diol?
The molecular formula of (2S)-pentane-1,2-diol is C5H12O2.
What is the molecular weight of (2S)-pentane-1,2-diol?
The molecular weight of (2S)-pentane-1,2-diol is 104.08 g/mol.
Where can I buy (2S)-pentane-1,2-diol?
You can request a quote for (2S)-pentane-1,2-diol directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for (2S)-pentane-1,2-diol?
Yes, KEHONG BIO provides custom synthesis services for (2S)-pentane-1,2-diol and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.