1,5-Pentanediol, 3,3-diethyl-
TL;DR: 1,5-Pentanediol, 3,3-diethyl- (CAS 51111-07-0) is a chemical compound with molecular formula C9H20O2 and molecular weight 160.15 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
3,3-diethylpentane-1,5-diol
Also Known As: 3,3-Diethyl-1,5-pentanediol, 1,5-Pentanediol, 3,3-diethyl-, 3,3-diethylpentane-1,5-diol, BRN 1361519, RefChem:221436
| Molecular Formula | C9H20O2 |
|---|---|
| Molecular Weight | 160.15 g/mol |
| LogP | 1.5576 |
| Topological Polar Surface Area | 40.46 Ų |
| Hydrogen Bond Donors | 2 |
| Hydrogen Bond Acceptors | 2 |
| Rotatable Bonds | 6 |
| Exact Mass | 160.14633 |
| Heavy Atoms | 11 |
| Complexity | 79.56352 |
Chemical Identifiers
| CAS Number | 51111-07-0 |
|---|---|
| SMILES | CCC(CC)(CCO)CCO |
Product Overview
1,5-Pentanediol, 3,3-diethyl- (CAS 51111-07-0), with molecular formula C9H20O2 and molecular weight 160.15 g/mol. IUPAC: 3,3-diethylpentane-1,5-diol.
Chemical Property Profile of 1,5-Pentanediol, 3,3-diethyl-
Property Insights of 1,5-Pentanediol, 3,3-diethyl-
The XLogP value of 1.5576 suggests moderate lipophilicity, balancing water solubility and membrane permeability for 1,5-Pentanediol, 3,3-diethyl-. With a topological polar surface area (TPSA) of 40.46 Ų, 1,5-Pentanediol, 3,3-diethyl- exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, 1,5-Pentanediol, 3,3-diethyl- 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 1,5-Pentanediol, 3,3-diethyl-?
The CAS number of 1,5-Pentanediol, 3,3-diethyl- is 51111-07-0.
What is the molecular formula of 1,5-Pentanediol, 3,3-diethyl-?
The molecular formula of 1,5-Pentanediol, 3,3-diethyl- is C9H20O2.
What is the molecular weight of 1,5-Pentanediol, 3,3-diethyl-?
The molecular weight of 1,5-Pentanediol, 3,3-diethyl- is 160.15 g/mol.
Where can I buy 1,5-Pentanediol, 3,3-diethyl-?
You can request a quote for 1,5-Pentanediol, 3,3-diethyl- directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 1,5-Pentanediol, 3,3-diethyl-?
Yes, KEHONG BIO provides custom synthesis services for 1,5-Pentanediol, 3,3-diethyl- and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.