1-羟基环己基苯基酮
TL;DR: 1-羟基环己基苯基酮 (CAS 947-19-3) is a chemical compound with molecular formula C13H16O2 and molecular weight 204.12 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
1-羟基环己基苯基酮
(1-hydroxycyclohexyl)-phenylmethanone
Also Known As: 1-Hydroxycyclohexyl phenyl ketone, (1-Hydroxycyclohexyl)(phenyl)methanone, 1-Benzoylcyclohexanol, Hydroxycyclohexyl phenyl ketone, Irgacure 184
| Molecular Formula | C13H16O2 |
|---|---|
| Molecular Weight | 204.12 g/mol |
| LogP | 2.6 |
| Topological Polar Surface Area | 37.3 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 2 |
| Rotatable Bonds | 2 |
| Exact Mass | 204.11504 |
| Heavy Atoms | 15 |
| Complexity | 223.0 |
Chemical Identifiers
| CAS Number | 947-19-3 |
|---|---|
| SMILES | C1CCC(CC1)(C(=O)C2=CC=CC=C2)O |
| InChIKey | QNODIIQQMGDSEF-UHFFFAOYSA-N |
Patent-Derived Application Labels
Derived from 21 IPC patent classification(s) across the SureChEMBL global patent database.
Product Overview
1-羟基环己基苯基酮 (CAS 947-19-3), with molecular formula C13H16O2 and molecular weight 204.12 g/mol. IUPAC: (1-hydroxycyclohexyl)-phenylmethanone.
Chemical Property Profile of 1-羟基环己基苯基酮
Property Insights of 1-羟基环己基苯基酮
The XLogP value of 2.6 suggests moderate lipophilicity, balancing water solubility and membrane permeability for 1-羟基环己基苯基酮. With a topological polar surface area (TPSA) of 37.3 Ų, 1-羟基环己基苯基酮 exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, 1-羟基环己基苯基酮 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 1-羟基环己基苯基酮?
The CAS number of 1-羟基环己基苯基酮 is 947-19-3.
What is the molecular formula of 1-羟基环己基苯基酮?
The molecular formula of 1-羟基环己基苯基酮 is C13H16O2.
What is the molecular weight of 1-羟基环己基苯基酮?
The molecular weight of 1-羟基环己基苯基酮 is 204.12 g/mol.
Where can I buy 1-羟基环己基苯基酮?
You can request a quote for 1-羟基环己基苯基酮 directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 1-羟基环己基苯基酮?
Yes, KEHONG BIO provides custom synthesis services for 1-羟基环己基苯基酮 and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.