1,3-Cyclohexanedione, 5-(hydroxymethyl)-
TL;DR: 1,3-Cyclohexanedione, 5-(hydroxymethyl)- (CAS 70150-65-1) is a chemical compound with molecular formula C7H10O3 and molecular weight 142.06 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
5-(hydroxymethyl)cyclohexane-1,3-dione
Also Known As: 5-(hydroxymethyl)cyclohexane-1,3-dione, 1,3-Cyclohexanedione, 5-(hydroxymethyl)-, 5-(Hydroxymethyl)-1,3-cyclohexanedione
| Molecular Formula | C7H10O3 |
|---|---|
| Molecular Weight | 142.06 g/mol |
| LogP | -0.8 |
| Topological Polar Surface Area | 54.4 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 3 |
| Rotatable Bonds | 1 |
| Exact Mass | 142.06299 |
| Heavy Atoms | 10 |
| Complexity | 146.0 |
Chemical Identifiers
| CAS Number | 70150-65-1 |
|---|---|
| SMILES | C1C(CC(=O)CC1=O)CO |
| InChIKey | SCTDHKQILWZJEX-UHFFFAOYSA-N |
Product Overview
1,3-Cyclohexanedione, 5-(hydroxymethyl)- (CAS 70150-65-1), with molecular formula C7H10O3 and molecular weight 142.06 g/mol. IUPAC: 5-(hydroxymethyl)cyclohexane-1,3-dione.
Chemical Property Profile of 1,3-Cyclohexanedione, 5-(hydroxymethyl)-
Property Insights of 1,3-Cyclohexanedione, 5-(hydroxymethyl)-
The XLogP value of -0.8 indicates that 1,3-Cyclohexanedione, 5-(hydroxymethyl)- is hydrophilic (water-soluble), making it suitable for aqueous formulations and biological assay applications. With a topological polar surface area (TPSA) of 54.4 Ų, 1,3-Cyclohexanedione, 5-(hydroxymethyl)- exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, 1,3-Cyclohexanedione, 5-(hydroxymethyl)- has 1 hydrogen bond donor(s) and 3 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, 5-(hydroxymethyl)-?
The CAS number of 1,3-Cyclohexanedione, 5-(hydroxymethyl)- is 70150-65-1.
What is the molecular formula of 1,3-Cyclohexanedione, 5-(hydroxymethyl)-?
The molecular formula of 1,3-Cyclohexanedione, 5-(hydroxymethyl)- is C7H10O3.
What is the molecular weight of 1,3-Cyclohexanedione, 5-(hydroxymethyl)-?
The molecular weight of 1,3-Cyclohexanedione, 5-(hydroxymethyl)- is 142.06 g/mol.
Where can I buy 1,3-Cyclohexanedione, 5-(hydroxymethyl)-?
You can request a quote for 1,3-Cyclohexanedione, 5-(hydroxymethyl)- 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, 5-(hydroxymethyl)-?
Yes, KEHONG BIO provides custom synthesis services for 1,3-Cyclohexanedione, 5-(hydroxymethyl)- and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.