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Methanone, [4-(1,1-dimethylethyl)phenyl](4-hydroxyphenyl)-
TL;DR: Methanone, [4-(1,1-dimethylethyl)phenyl](4-hydroxyphenyl)- (CAS 55044-96-7) is a chemical compound with molecular formula C17H18O2 and molecular weight 254.13 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
(4-tert-butylphenyl)-(4-hydroxyphenyl)methanone
Also Known As: methanone, 4-tert-Butyl-4'-hydroxybenzophenone, (4-tert-Butylphenyl)(4-hydroxyphenyl)methanone, 4 -Hydroxy-4-tert-butylbenzophenone, 4-(4-TERT-BUTYLBENZOYL)PHENOL
| Molecular Formula | C17H18O2 |
|---|---|
| Molecular Weight | 254.13 g/mol |
| LogP | 4.7 |
| Topological Polar Surface Area | 37.3 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 2 |
| Rotatable Bonds | 3 |
| Exact Mass | 254.13068 |
| Heavy Atoms | 19 |
| Complexity | 300.0 |
Chemical Identifiers
| CAS Number | 55044-96-7 |
|---|---|
| SMILES | CC(C)(C)C1=CC=C(C=C1)C(=O)C2=CC=C(C=C2)O |
| InChIKey | GHWOFLNXFQAIFV-UHFFFAOYSA-N |
Patent-Derived Application Labels
Derived from 2 IPC patent classification(s) across the SureChEMBL global patent database.
Product Overview
Methanone, [4-(1,1-dimethylethyl)phenyl](4-hydroxyphenyl)- (CAS 55044-96-7), with molecular formula C17H18O2 and molecular weight 254.13 g/mol. IUPAC: (4-tert-butylphenyl)-(4-hydroxyphenyl)methanone.
Chemical Property Profile of Methanone, [4-(1,1-dimethylethyl)phenyl](4-hydroxyphenyl)-
Property Insights of Methanone, [4-(1,1-dimethylethyl)phenyl](4-hydroxyphenyl)-
The XLogP value of 4.7 indicates that Methanone, [4-(1,1-dimethylethyl)phenyl](4-hydroxyphenyl)- is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. With a topological polar surface area (TPSA) of 37.3 Ų, Methanone, [4-(1,1-dimethylethyl)phenyl](4-hydroxyphenyl)- exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, Methanone, [4-(1,1-dimethylethyl)phenyl](4-hydroxyphenyl)- 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 Methanone, [4-(1,1-dimethylethyl)phenyl](4-hydroxyphenyl)-?
The CAS number of Methanone, [4-(1,1-dimethylethyl)phenyl](4-hydroxyphenyl)- is 55044-96-7.
What is the molecular formula of Methanone, [4-(1,1-dimethylethyl)phenyl](4-hydroxyphenyl)-?
The molecular formula of Methanone, [4-(1,1-dimethylethyl)phenyl](4-hydroxyphenyl)- is C17H18O2.
What is the molecular weight of Methanone, [4-(1,1-dimethylethyl)phenyl](4-hydroxyphenyl)-?
The molecular weight of Methanone, [4-(1,1-dimethylethyl)phenyl](4-hydroxyphenyl)- is 254.13 g/mol.
Where can I buy Methanone, [4-(1,1-dimethylethyl)phenyl](4-hydroxyphenyl)-?
You can request a quote for Methanone, [4-(1,1-dimethylethyl)phenyl](4-hydroxyphenyl)- directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for Methanone, [4-(1,1-dimethylethyl)phenyl](4-hydroxyphenyl)-?
Yes, KEHONG BIO provides custom synthesis services for Methanone, [4-(1,1-dimethylethyl)phenyl](4-hydroxyphenyl)- and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.