Phloroglucinol, 2,4-divaleryl-
TL;DR: Phloroglucinol, 2,4-divaleryl- (CAS 3118-32-9) is a chemical compound with molecular formula C16H22O5 and molecular weight 294.15 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
1-(2,4,6-trihydroxy-3-pentanoylphenyl)pentan-1-one
Also Known As: divaleryl phloroglucinol, Phloroglucinol, 2,4-divaleryl-, 1,1'- di-1-pentanone, 1-(2,4,6-trihydroxy-3-pentanoylphenyl)pentan-1-one, 1,1 -(2,4,6-Trihydroxy-m-phenylene)di-1-pentanone
| Molecular Formula | C16H22O5 |
|---|---|
| Molecular Weight | 294.15 g/mol |
| LogP | 4.1 |
| Topological Polar Surface Area | 94.8 Ų |
| Hydrogen Bond Donors | 3 |
| Hydrogen Bond Acceptors | 5 |
| Rotatable Bonds | 8 |
| Exact Mass | 294.14673 |
| Heavy Atoms | 21 |
| Complexity | 323.0 |
Chemical Identifiers
| CAS Number | 3118-32-9 |
|---|---|
| SMILES | CCCCC(=O)C1=C(C(=C(C=C1O)O)C(=O)CCCC)O |
| InChIKey | SOQOIZJAUBTPFT-UHFFFAOYSA-N |
Patent-Derived Application Labels
Derived from 1 IPC patent classification(s) across the SureChEMBL global patent database.
Product Overview
Phloroglucinol, 2,4-divaleryl- (CAS 3118-32-9), with molecular formula C16H22O5 and molecular weight 294.15 g/mol. IUPAC: 1-(2,4,6-trihydroxy-3-pentanoylphenyl)pentan-1-one.
Chemical Property Profile of Phloroglucinol, 2,4-divaleryl-
Property Insights of Phloroglucinol, 2,4-divaleryl-
The XLogP value of 4.1 indicates that Phloroglucinol, 2,4-divaleryl- is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. The TPSA of 94.8 Ų falls within the moderate polarity range, balancing permeability and solubility for Phloroglucinol, 2,4-divaleryl-. Following Lipinski's Rule of Five, Phloroglucinol, 2,4-divaleryl- has 3 hydrogen bond donor(s) and 5 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 Phloroglucinol, 2,4-divaleryl-?
The CAS number of Phloroglucinol, 2,4-divaleryl- is 3118-32-9.
What is the molecular formula of Phloroglucinol, 2,4-divaleryl-?
The molecular formula of Phloroglucinol, 2,4-divaleryl- is C16H22O5.
What is the molecular weight of Phloroglucinol, 2,4-divaleryl-?
The molecular weight of Phloroglucinol, 2,4-divaleryl- is 294.15 g/mol.
Where can I buy Phloroglucinol, 2,4-divaleryl-?
You can request a quote for Phloroglucinol, 2,4-divaleryl- directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for Phloroglucinol, 2,4-divaleryl-?
Yes, KEHONG BIO provides custom synthesis services for Phloroglucinol, 2,4-divaleryl- and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.