2-Cyclohexen-1-one, 2,2'-methylenebis[3-hydroxy-
TL;DR: 2-Cyclohexen-1-one, 2,2'-methylenebis[3-hydroxy- (CAS 22381-57-3) is a chemical compound with molecular formula C13H16O4 and molecular weight 236.10 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
3-hydroxy-2-[(2-hydroxy-6-oxocyclohexen-1-yl)methyl]cyclohex-2-en-1-one
Also Known As: 2,2'-Methylenebis, 2,2'-methylenebis(3-hydroxycyclohex-2-enone), 2-Cyclohexen-1-one, 2,2'-methylenebis*3-hydroxy-, 2-Cyclohexen-1-one, 2,2'-methylenebis[3-hydroxy-, 2,2'-Methylenebis(3-hydroxy-2-cyclohexen-1-one)
| Molecular Formula | C13H16O4 |
|---|---|
| Molecular Weight | 236.10 g/mol |
| LogP | 0.5 |
| Topological Polar Surface Area | 74.6 Ų |
| Hydrogen Bond Donors | 2 |
| Hydrogen Bond Acceptors | 4 |
| Rotatable Bonds | 2 |
| Exact Mass | 236.10486 |
| Heavy Atoms | 17 |
| Complexity | 389.0 |
Chemical Identifiers
| CAS Number | 22381-57-3 |
|---|---|
| SMILES | C1CC(=C(C(=O)C1)CC2=C(CCCC2=O)O)O |
| InChIKey | OSAJQEFTJOLJFJ-UHFFFAOYSA-N |
Product Overview
2-Cyclohexen-1-one, 2,2'-methylenebis[3-hydroxy- (CAS 22381-57-3), with molecular formula C13H16O4 and molecular weight 236.10 g/mol. IUPAC: 3-hydroxy-2-[(2-hydroxy-6-oxocyclohexen-1-yl)methyl]cyclohex-2-en-1-one.
Chemical Property Profile of 2-Cyclohexen-1-one, 2,2'-methylenebis[3-hydroxy-
Property Insights of 2-Cyclohexen-1-one, 2,2'-methylenebis[3-hydroxy-
The XLogP value of 0.5 suggests moderate lipophilicity, balancing water solubility and membrane permeability for 2-Cyclohexen-1-one, 2,2'-methylenebis[3-hydroxy-. The TPSA of 74.6 Ų falls within the moderate polarity range, balancing permeability and solubility for 2-Cyclohexen-1-one, 2,2'-methylenebis[3-hydroxy-. Following Lipinski's Rule of Five, 2-Cyclohexen-1-one, 2,2'-methylenebis[3-hydroxy- has 2 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 2-Cyclohexen-1-one, 2,2'-methylenebis[3-hydroxy-?
The CAS number of 2-Cyclohexen-1-one, 2,2'-methylenebis[3-hydroxy- is 22381-57-3.
What is the molecular formula of 2-Cyclohexen-1-one, 2,2'-methylenebis[3-hydroxy-?
The molecular formula of 2-Cyclohexen-1-one, 2,2'-methylenebis[3-hydroxy- is C13H16O4.
What is the molecular weight of 2-Cyclohexen-1-one, 2,2'-methylenebis[3-hydroxy-?
The molecular weight of 2-Cyclohexen-1-one, 2,2'-methylenebis[3-hydroxy- is 236.10 g/mol.
Where can I buy 2-Cyclohexen-1-one, 2,2'-methylenebis[3-hydroxy-?
You can request a quote for 2-Cyclohexen-1-one, 2,2'-methylenebis[3-hydroxy- directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 2-Cyclohexen-1-one, 2,2'-methylenebis[3-hydroxy-?
Yes, KEHONG BIO provides custom synthesis services for 2-Cyclohexen-1-one, 2,2'-methylenebis[3-hydroxy- and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.