1-Propanone, 2,2-dichloro-3-hydroxy-1-phenyl-
TL;DR: 1-Propanone, 2,2-dichloro-3-hydroxy-1-phenyl- (CAS 54824-08-7) is a chemical compound with molecular formula C9H8Cl2O2 and molecular weight 217.99 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
2,2-dichloro-3-hydroxy-1-phenylpropan-1-one
Also Known As: 1-Propanone, 2,2-dichloro-3-hydroxy-1-phenyl-, 2,2-dichloro-3-hydroxy-1-phenylpropan-1-one, 2,2-Dichlor-3-oxo-3-phenyl-1-propanol, 2,2-Dichloro-3-hydroxy-1-phenyl-1-propanone, 1-Phenyl-2,2-dichloro-3-hydroxy-1-propanone
| Molecular Formula | C9H8Cl2O2 |
|---|---|
| Molecular Weight | 217.99 g/mol |
| LogP | 2.1 |
| Topological Polar Surface Area | 37.3 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 2 |
| Rotatable Bonds | 3 |
| Exact Mass | 217.99013 |
| Heavy Atoms | 13 |
| Complexity | 186.0 |
Chemical Identifiers
| CAS Number | 54824-08-7 |
|---|---|
| SMILES | C1=CC=C(C=C1)C(=O)C(CO)(Cl)Cl |
| InChIKey | TUJXSTYBXGKZOG-UHFFFAOYSA-N |
Product Overview
1-Propanone, 2,2-dichloro-3-hydroxy-1-phenyl- (CAS 54824-08-7), with molecular formula C9H8Cl2O2 and molecular weight 217.99 g/mol. IUPAC: 2,2-dichloro-3-hydroxy-1-phenylpropan-1-one.
Chemical Property Profile of 1-Propanone, 2,2-dichloro-3-hydroxy-1-phenyl-
Property Insights of 1-Propanone, 2,2-dichloro-3-hydroxy-1-phenyl-
The XLogP value of 2.1 suggests moderate lipophilicity, balancing water solubility and membrane permeability for 1-Propanone, 2,2-dichloro-3-hydroxy-1-phenyl-. With a topological polar surface area (TPSA) of 37.3 Ų, 1-Propanone, 2,2-dichloro-3-hydroxy-1-phenyl- exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, 1-Propanone, 2,2-dichloro-3-hydroxy-1-phenyl- 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-Propanone, 2,2-dichloro-3-hydroxy-1-phenyl-?
The CAS number of 1-Propanone, 2,2-dichloro-3-hydroxy-1-phenyl- is 54824-08-7.
What is the molecular formula of 1-Propanone, 2,2-dichloro-3-hydroxy-1-phenyl-?
The molecular formula of 1-Propanone, 2,2-dichloro-3-hydroxy-1-phenyl- is C9H8Cl2O2.
What is the molecular weight of 1-Propanone, 2,2-dichloro-3-hydroxy-1-phenyl-?
The molecular weight of 1-Propanone, 2,2-dichloro-3-hydroxy-1-phenyl- is 217.99 g/mol.
Where can I buy 1-Propanone, 2,2-dichloro-3-hydroxy-1-phenyl-?
You can request a quote for 1-Propanone, 2,2-dichloro-3-hydroxy-1-phenyl- directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 1-Propanone, 2,2-dichloro-3-hydroxy-1-phenyl-?
Yes, KEHONG BIO provides custom synthesis services for 1-Propanone, 2,2-dichloro-3-hydroxy-1-phenyl- and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.