2,4-Hexanediol, 2-(p-chlorophenyl)-4-ethyl-
TL;DR: 2,4-Hexanediol, 2-(p-chlorophenyl)-4-ethyl- (CAS 21133-88-0) is a chemical compound with molecular formula C14H21ClO2 and molecular weight 256.12 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
2-(4-chlorophenyl)-4-ethylhexane-2,4-diol
Also Known As: 2-(4-chlorophenyl)-4-ethylhexane-2,4-diol, 2- -4-ethyl-2,4-hexanediol, 2-(p-Chlorophenyl)-4-ethyl-2,4-hexanediol, 2,4-HEXANEDIOL, 2-(p-CHLOROPHENYL)-4-ETHYL-, p-Chlorophenyl-1-methyl-1-diethyl-3,3 propanediol-1,3
| Molecular Formula | C14H21ClO2 |
|---|---|
| Molecular Weight | 256.12 g/mol |
| LogP | 3.2 |
| Topological Polar Surface Area | 40.5 Ų |
| Hydrogen Bond Donors | 2 |
| Hydrogen Bond Acceptors | 2 |
| Rotatable Bonds | 5 |
| Exact Mass | 256.12302 |
| Heavy Atoms | 17 |
| Complexity | 232.0 |
Chemical Identifiers
| CAS Number | 21133-88-0 |
|---|---|
| SMILES | CCC(CC)(CC(C)(C1=CC=C(C=C1)Cl)O)O |
| InChIKey | OGGGMEBJFMVQHK-UHFFFAOYSA-N |
Product Overview
2,4-Hexanediol, 2-(p-chlorophenyl)-4-ethyl- (CAS 21133-88-0), with molecular formula C14H21ClO2 and molecular weight 256.12 g/mol. IUPAC: 2-(4-chlorophenyl)-4-ethylhexane-2,4-diol.
Chemical Property Profile of 2,4-Hexanediol, 2-(p-chlorophenyl)-4-ethyl-
Property Insights of 2,4-Hexanediol, 2-(p-chlorophenyl)-4-ethyl-
The XLogP value of 3.2 indicates that 2,4-Hexanediol, 2-(p-chlorophenyl)-4-ethyl- is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. With a topological polar surface area (TPSA) of 40.5 Ų, 2,4-Hexanediol, 2-(p-chlorophenyl)-4-ethyl- exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, 2,4-Hexanediol, 2-(p-chlorophenyl)-4-ethyl- 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-Hexanediol, 2-(p-chlorophenyl)-4-ethyl-?
The CAS number of 2,4-Hexanediol, 2-(p-chlorophenyl)-4-ethyl- is 21133-88-0.
What is the molecular formula of 2,4-Hexanediol, 2-(p-chlorophenyl)-4-ethyl-?
The molecular formula of 2,4-Hexanediol, 2-(p-chlorophenyl)-4-ethyl- is C14H21ClO2.
What is the molecular weight of 2,4-Hexanediol, 2-(p-chlorophenyl)-4-ethyl-?
The molecular weight of 2,4-Hexanediol, 2-(p-chlorophenyl)-4-ethyl- is 256.12 g/mol.
Where can I buy 2,4-Hexanediol, 2-(p-chlorophenyl)-4-ethyl-?
You can request a quote for 2,4-Hexanediol, 2-(p-chlorophenyl)-4-ethyl- directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 2,4-Hexanediol, 2-(p-chlorophenyl)-4-ethyl-?
Yes, KEHONG BIO provides custom synthesis services for 2,4-Hexanediol, 2-(p-chlorophenyl)-4-ethyl- and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.