2-(Hydroxy(phenyl)methyl)-2-methylcyclohexanone
TL;DR: 2-(Hydroxy(phenyl)methyl)-2-methylcyclohexanone (CAS 54322-99-5) is a chemical compound with molecular formula C14H18O2 and molecular weight 218.13 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
2-[hydroxy(phenyl)methyl]-2-methylcyclohexan-1-one
Also Known As: 2-Hpmmc, 2-(Hydroxy(phenyl)methyl)-2-methylcyclohexanone, 2-[hydroxy(phenyl)methyl]-2-methylcyclohexan-1-one, 2-(alpha-Hydroxybenzyl)-2-methylcyclohexanone, 2-[hydroxy(phenyl)methyl]-2-methylcyclohexanone
| Molecular Formula | C14H18O2 |
|---|---|
| Molecular Weight | 218.13 g/mol |
| LogP | 2.7 |
| Topological Polar Surface Area | 37.3 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 2 |
| Rotatable Bonds | 2 |
| Exact Mass | 218.13068 |
| Heavy Atoms | 16 |
| Complexity | 255.0 |
Chemical Identifiers
| CAS Number | 54322-99-5 |
|---|---|
| SMILES | CC1(CCCCC1=O)C(C2=CC=CC=C2)O |
| InChIKey | OBNSGPGWBHNHOX-UHFFFAOYSA-N |
Product Overview
2-(Hydroxy(phenyl)methyl)-2-methylcyclohexanone (CAS 54322-99-5), with molecular formula C14H18O2 and molecular weight 218.13 g/mol. IUPAC: 2-[hydroxy(phenyl)methyl]-2-methylcyclohexan-1-one.
Chemical Property Profile of 2-(Hydroxy(phenyl)methyl)-2-methylcyclohexanone
Property Insights of 2-(Hydroxy(phenyl)methyl)-2-methylcyclohexanone
The XLogP value of 2.7 suggests moderate lipophilicity, balancing water solubility and membrane permeability for 2-(Hydroxy(phenyl)methyl)-2-methylcyclohexanone. With a topological polar surface area (TPSA) of 37.3 Ų, 2-(Hydroxy(phenyl)methyl)-2-methylcyclohexanone exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, 2-(Hydroxy(phenyl)methyl)-2-methylcyclohexanone has 1 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-(Hydroxy(phenyl)methyl)-2-methylcyclohexanone?
The CAS number of 2-(Hydroxy(phenyl)methyl)-2-methylcyclohexanone is 54322-99-5.
What is the molecular formula of 2-(Hydroxy(phenyl)methyl)-2-methylcyclohexanone?
The molecular formula of 2-(Hydroxy(phenyl)methyl)-2-methylcyclohexanone is C14H18O2.
What is the molecular weight of 2-(Hydroxy(phenyl)methyl)-2-methylcyclohexanone?
The molecular weight of 2-(Hydroxy(phenyl)methyl)-2-methylcyclohexanone is 218.13 g/mol.
Where can I buy 2-(Hydroxy(phenyl)methyl)-2-methylcyclohexanone?
You can request a quote for 2-(Hydroxy(phenyl)methyl)-2-methylcyclohexanone directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 2-(Hydroxy(phenyl)methyl)-2-methylcyclohexanone?
Yes, KEHONG BIO provides custom synthesis services for 2-(Hydroxy(phenyl)methyl)-2-methylcyclohexanone and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.