4-Propylheptan-3-ol
TL;DR: 4-Propylheptan-3-ol (CAS 51864-90-5) is a chemical compound with molecular formula C10H22O and molecular weight 158.17 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
4-propylheptan-3-ol
Also Known As: 4-propylheptan-3-ol, Propyl-4 heptanol-3, 3-Heptanol, 4-propyl-, Propyl-4 heptanol-3 [French], RefChem:1071485
| Molecular Formula | C10H22O |
|---|---|
| Molecular Weight | 158.17 g/mol |
| LogP | 2.9737 |
| Topological Polar Surface Area | 20.23 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 1 |
| Rotatable Bonds | 6 |
| Exact Mass | 158.16707 |
| Heavy Atoms | 11 |
| Complexity | 74.94196 |
Chemical Identifiers
| CAS Number | 51864-90-5 |
|---|---|
| SMILES | CCCC(CCC)C(CC)O |
Product Overview
4-Propylheptan-3-ol (CAS 51864-90-5), with molecular formula C10H22O and molecular weight 158.17 g/mol. IUPAC: 4-propylheptan-3-ol.
Chemical Property Profile of 4-Propylheptan-3-ol
Property Insights of 4-Propylheptan-3-ol
The XLogP value of 2.9737 suggests moderate lipophilicity, balancing water solubility and membrane permeability for 4-Propylheptan-3-ol. With a topological polar surface area (TPSA) of 20.23 Ų, 4-Propylheptan-3-ol exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, 4-Propylheptan-3-ol has 1 hydrogen bond donor(s) and 1 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 4-Propylheptan-3-ol?
The CAS number of 4-Propylheptan-3-ol is 51864-90-5.
What is the molecular formula of 4-Propylheptan-3-ol?
The molecular formula of 4-Propylheptan-3-ol is C10H22O.
What is the molecular weight of 4-Propylheptan-3-ol?
The molecular weight of 4-Propylheptan-3-ol is 158.17 g/mol.
Where can I buy 4-Propylheptan-3-ol?
You can request a quote for 4-Propylheptan-3-ol directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 4-Propylheptan-3-ol?
Yes, KEHONG BIO provides custom synthesis services for 4-Propylheptan-3-ol and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.