1,3-Cyclohexanedione, 2,2'-(phenylmethylene)bis-
TL;DR: 1,3-Cyclohexanedione, 2,2'-(phenylmethylene)bis- (CAS 55771-10-3) is a chemical compound with molecular formula C19H20O4 and molecular weight 312.14 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
2-[(2,6-dioxocyclohexyl)-phenylmethyl]cyclohexane-1,3-dione
Also Known As: Benzyliden-bis-dihydroresorcin, 1,3-Cyclohexanedione, 2,2'-(phenylmethylene)bis-, AB01117351-03, 2,2'-(Phenylmethylene)di(cyclohexane-1,3-dione), 2,2'-(phenylmethylene)bis(cyclohexane-1,3-dione)
| Molecular Formula | C19H20O4 |
|---|---|
| Molecular Weight | 312.14 g/mol |
| LogP | 2.6468 |
| Topological Polar Surface Area | 68.28 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 4 |
| Rotatable Bonds | 3 |
| Exact Mass | 312.13617 |
| Heavy Atoms | 23 |
| Complexity | 576.59326 |
Chemical Identifiers
| CAS Number | 55771-10-3 |
|---|---|
| SMILES | C1CC(=O)C(C(=O)C1)C(C2C(=O)CCCC2=O)C3=CC=CC=C3 |
Product Overview
1,3-Cyclohexanedione, 2,2'-(phenylmethylene)bis- (CAS 55771-10-3), with molecular formula C19H20O4 and molecular weight 312.14 g/mol. IUPAC: 2-[(2,6-dioxocyclohexyl)-phenylmethyl]cyclohexane-1,3-dione.
Chemical Property Profile of 1,3-Cyclohexanedione, 2,2'-(phenylmethylene)bis-
Property Insights of 1,3-Cyclohexanedione, 2,2'-(phenylmethylene)bis-
The XLogP value of 2.6468 suggests moderate lipophilicity, balancing water solubility and membrane permeability for 1,3-Cyclohexanedione, 2,2'-(phenylmethylene)bis-. The TPSA of 68.28 Ų falls within the moderate polarity range, balancing permeability and solubility for 1,3-Cyclohexanedione, 2,2'-(phenylmethylene)bis-. Following Lipinski's Rule of Five, 1,3-Cyclohexanedione, 2,2'-(phenylmethylene)bis- has 0 hydrogen bond donor(s) and 4 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 1,3-Cyclohexanedione, 2,2'-(phenylmethylene)bis-?
The CAS number of 1,3-Cyclohexanedione, 2,2'-(phenylmethylene)bis- is 55771-10-3.
What is the molecular formula of 1,3-Cyclohexanedione, 2,2'-(phenylmethylene)bis-?
The molecular formula of 1,3-Cyclohexanedione, 2,2'-(phenylmethylene)bis- is C19H20O4.
What is the molecular weight of 1,3-Cyclohexanedione, 2,2'-(phenylmethylene)bis-?
The molecular weight of 1,3-Cyclohexanedione, 2,2'-(phenylmethylene)bis- is 312.14 g/mol.
Where can I buy 1,3-Cyclohexanedione, 2,2'-(phenylmethylene)bis-?
You can request a quote for 1,3-Cyclohexanedione, 2,2'-(phenylmethylene)bis- directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 1,3-Cyclohexanedione, 2,2'-(phenylmethylene)bis-?
Yes, KEHONG BIO provides custom synthesis services for 1,3-Cyclohexanedione, 2,2'-(phenylmethylene)bis- and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.