2,4-pentanediol, (R*,S*)-
TL;DR: 2,4-pentanediol, (R*,S*)- (CAS 3950-21-8) 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.
(2R,4S)-pentane-2,4-diol
Also Known As: (R*,S*)-Pentane-2,4-diol, pentan-2,4-diol, meso-2,4-pentanediol, 2,4-Pentanediol, meso-, syn-2,4-pentanediol
| Molecular Formula | C5H12O2 |
|---|---|
| Molecular Weight | 104.08 g/mol |
| LogP | 0.1381 |
| Topological Polar Surface Area | 40.46 Ų |
| Hydrogen Bond Donors | 2 |
| Hydrogen Bond Acceptors | 2 |
| Rotatable Bonds | 2 |
| Exact Mass | 104.08373 |
| Heavy Atoms | 7 |
| Complexity | 35.344814 |
Chemical Identifiers
| CAS Number | 3950-21-8 |
|---|---|
| SMILES | C[C@H](C[C@H](C)O)O |
Product Overview
2,4-pentanediol, (R*,S*)- (CAS 3950-21-8), with molecular formula C5H12O2 and molecular weight 104.08 g/mol. IUPAC: (2R,4S)-pentane-2,4-diol.
Chemical Property Profile of 2,4-pentanediol, (R*,S*)-
Property Insights of 2,4-pentanediol, (R*,S*)-
The XLogP value of 0.1381 suggests moderate lipophilicity, balancing water solubility and membrane permeability for 2,4-pentanediol, (R*,S*)-. With a topological polar surface area (TPSA) of 40.46 Ų, 2,4-pentanediol, (R*,S*)- exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, 2,4-pentanediol, (R*,S*)- 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 2,4-pentanediol, (R*,S*)-?
The CAS number of 2,4-pentanediol, (R*,S*)- is 3950-21-8.
What is the molecular formula of 2,4-pentanediol, (R*,S*)-?
The molecular formula of 2,4-pentanediol, (R*,S*)- is C5H12O2.
What is the molecular weight of 2,4-pentanediol, (R*,S*)-?
The molecular weight of 2,4-pentanediol, (R*,S*)- is 104.08 g/mol.
Where can I buy 2,4-pentanediol, (R*,S*)-?
You can request a quote for 2,4-pentanediol, (R*,S*)- directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 2,4-pentanediol, (R*,S*)-?
Yes, KEHONG BIO provides custom synthesis services for 2,4-pentanediol, (R*,S*)- and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.