Benzenemethanol, 3,4-dichloro-alpha,alpha-bis(trifluoromethyl)-
TL;DR: Benzenemethanol, 3,4-dichloro-alpha,alpha-bis(trifluoromethyl)- (CAS 65072-48-2) is a chemical compound with molecular formula C9H4Cl2F6O and molecular weight 311.95 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
2-(3,4-dichlorophenyl)-1,1,1,3,3,3-hexafluoropropan-2-ol
Also Known As: 2-(3,4-dichlorophenyl)-1,1,1,3,3,3-hexafluoropropan-2-ol, 2-(3,4-DICHLOROPHENYL)-1,1,1,3,3,3-HEXAFLUORO-PROPAN-2-OL, 3,5-Trifluromethylbenzoylacetonitrile, 7433AE, Benzyl alcohol, 3,4-dichloro-alpha,alpha-bis(trifluoromethyl)-
| Molecular Formula | C9H4Cl2F6O |
|---|---|
| Molecular Weight | 311.95 g/mol |
| LogP | 4.4 |
| Topological Polar Surface Area | 20.2 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 7 |
| Rotatable Bonds | 1 |
| Exact Mass | 311.95435 |
| Heavy Atoms | 18 |
| Complexity | 288.0 |
Chemical Identifiers
| CAS Number | 65072-48-2 |
|---|---|
| SMILES | C1=CC(=C(C=C1C(C(F)(F)F)(C(F)(F)F)O)Cl)Cl |
| InChIKey | JCCWOKZXPBZZBV-UHFFFAOYSA-N |
Product Overview
Benzenemethanol, 3,4-dichloro-alpha,alpha-bis(trifluoromethyl)- (CAS 65072-48-2), with molecular formula C9H4Cl2F6O and molecular weight 311.95 g/mol. IUPAC: 2-(3,4-dichlorophenyl)-1,1,1,3,3,3-hexafluoropropan-2-ol.
Chemical Property Profile of Benzenemethanol, 3,4-dichloro-alpha,alpha-bis(trifluoromethyl)-
Property Insights of Benzenemethanol, 3,4-dichloro-alpha,alpha-bis(trifluoromethyl)-
The XLogP value of 4.4 indicates that Benzenemethanol, 3,4-dichloro-alpha,alpha-bis(trifluoromethyl)- is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. With a topological polar surface area (TPSA) of 20.2 Ų, Benzenemethanol, 3,4-dichloro-alpha,alpha-bis(trifluoromethyl)- exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, Benzenemethanol, 3,4-dichloro-alpha,alpha-bis(trifluoromethyl)- has 1 hydrogen bond donor(s) and 7 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 Benzenemethanol, 3,4-dichloro-alpha,alpha-bis(trifluoromethyl)-?
The CAS number of Benzenemethanol, 3,4-dichloro-alpha,alpha-bis(trifluoromethyl)- is 65072-48-2.
What is the molecular formula of Benzenemethanol, 3,4-dichloro-alpha,alpha-bis(trifluoromethyl)-?
The molecular formula of Benzenemethanol, 3,4-dichloro-alpha,alpha-bis(trifluoromethyl)- is C9H4Cl2F6O.
What is the molecular weight of Benzenemethanol, 3,4-dichloro-alpha,alpha-bis(trifluoromethyl)-?
The molecular weight of Benzenemethanol, 3,4-dichloro-alpha,alpha-bis(trifluoromethyl)- is 311.95 g/mol.
Where can I buy Benzenemethanol, 3,4-dichloro-alpha,alpha-bis(trifluoromethyl)-?
You can request a quote for Benzenemethanol, 3,4-dichloro-alpha,alpha-bis(trifluoromethyl)- directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for Benzenemethanol, 3,4-dichloro-alpha,alpha-bis(trifluoromethyl)-?
Yes, KEHONG BIO provides custom synthesis services for Benzenemethanol, 3,4-dichloro-alpha,alpha-bis(trifluoromethyl)- and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.