2-Propyl-1,3-propanediol
TL;DR: 2-Propyl-1,3-propanediol (CAS 2612-28-4) is a chemical compound with molecular formula C6H14O2 and molecular weight 118.10 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
2-propylpropane-1,3-diol
Also Known As: 2-propylpropane-1,3-diol, 1,3-Propanediol, 2-propyl-, 2-n-Propylpropane-1,3-diol, 2-n-Propyl-1,3-propanediol, 2-PROPYL-1,3-PROPANEDIOL
| Molecular Formula | C6H14O2 |
|---|---|
| Molecular Weight | 118.10 g/mol |
| LogP | 0.3873 |
| Topological Polar Surface Area | 40.46 Ų |
| Hydrogen Bond Donors | 2 |
| Hydrogen Bond Acceptors | 2 |
| Rotatable Bonds | 4 |
| Exact Mass | 118.09938 |
| Heavy Atoms | 8 |
| Complexity | 41.793194 |
Chemical Identifiers
| CAS Number | 2612-28-4 |
|---|---|
| SMILES | CCCC(CO)CO |
Product Overview
2-Propyl-1,3-propanediol (CAS 2612-28-4), with molecular formula C6H14O2 and molecular weight 118.10 g/mol. IUPAC: 2-propylpropane-1,3-diol.
Chemical Property Profile of 2-Propyl-1,3-propanediol
Property Insights of 2-Propyl-1,3-propanediol
The XLogP value of 0.3873 suggests moderate lipophilicity, balancing water solubility and membrane permeability for 2-Propyl-1,3-propanediol. With a topological polar surface area (TPSA) of 40.46 Ų, 2-Propyl-1,3-propanediol exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, 2-Propyl-1,3-propanediol 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-Propyl-1,3-propanediol?
The CAS number of 2-Propyl-1,3-propanediol is 2612-28-4.
What is the molecular formula of 2-Propyl-1,3-propanediol?
The molecular formula of 2-Propyl-1,3-propanediol is C6H14O2.
What is the molecular weight of 2-Propyl-1,3-propanediol?
The molecular weight of 2-Propyl-1,3-propanediol is 118.10 g/mol.
Where can I buy 2-Propyl-1,3-propanediol?
You can request a quote for 2-Propyl-1,3-propanediol directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 2-Propyl-1,3-propanediol?
Yes, KEHONG BIO provides custom synthesis services for 2-Propyl-1,3-propanediol and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.