(3,5-ditert-butyl-4-hydroxyphenyl)-(2,4,6-trimethylphenyl)methanone

C24H32O2 — CID 25142145

IUPAC(3,5-ditert-butyl-4-hydroxyphenyl)-(2,4,6-trimethylphenyl)methanone
SMILESCc1cc(C)c(C(=O)c2cc(C(C)(C)C)c(O)c(C(C)(C)C)c2)c(C)c1
InChIInChI=1S/C24H32O2/c1-14-10-15(2)20(16(3)11-14)21(25)17-12-18(23(4,5)6)22(26)19(13-17)24(7,8)9/h10-13,26H,1-9H3
InChIKeyZKIHEBGUERGHGT-UHFFFAOYSA-N
MW352.52 g/mol
LogP6.14
Rot. Bonds2

About (3,5-ditert-butyl-4-hydroxyphenyl)-(2,4,6-trimethylphenyl)methanone

(3,5-ditert-butyl-4-hydroxyphenyl)-(2,4,6-trimethylphenyl)methanone (PubChem CID 25142145) has the molecular formula C24H32O2 and a molecular weight of 352.52 g/mol. Its IUPAC name is (3,5-ditert-butyl-4-hydroxyphenyl)-(2,4,6-trimethylphenyl)methanone.

Molecular Properties

Compound Name(3,5-ditert-butyl-4-hydroxyphenyl)-(2,4,6-trimethylphenyl)methanone
PubChem CID25142145
Molecular FormulaC24H32O2
Molecular Weight352.52 g/mol
Exact Mass352.24
IUPAC Name(3,5-ditert-butyl-4-hydroxyphenyl)-(2,4,6-trimethylphenyl)methanone
SMILESCc1cc(C)c(C(=O)c2cc(C(C)(C)C)c(O)c(C(C)(C)C)c2)c(C)c1
InChIInChI=1S/C24H32O2/c1-14-10-15(2)20(16(3)11-14)21(25)17-12-18(23(4,5)6)22(26)19(13-17)24(7,8)9/h10-13,26H,1-9H3
InChIKeyZKIHEBGUERGHGT-UHFFFAOYSA-N
XLogP6.14
TPSA37.30 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds2
Heavy Atoms26
Complexity—

Lipinski Rule of Five

1 violation

RuleValue
MW ≤ 500352.52
LogP ≤ 56.14
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

Analyze (3,5-ditert-butyl-4-hydroxyphenyl)-(2,4,6-trimethylphenyl)methanone with MolForge

Explore ADMET properties, 3D molecular structure, drug-likeness score, and discover similar compounds using our AI-powered platform.

Launch Full Analysis

Related Compounds

Phenol, 2,6-bis(1,1-dimethylethyl)-4-methyl-, sodium salt
CID 87970249
2,6-ditert-butyl-4-methylphenol;hydroxy(oxo)phosphanium
CID 135147079
2-tert-butyl-4,6-dimethylphenol
CID 87814182
tris(2,6-ditert-butyl-4-methylphenol);samarium
CID 11193670
2,6-ditert-butyl-4-methylphenol;methanol
CID 161478470
1-(3,5-ditert-butyl-4-hydroxyphenyl)ethanone
CID 616296
2,6-ditert-butyl-4-methylphenol;zirconium;hydrochloride
CID 87931050
2,6-ditert-butyl-4-methylphenol;titanium(2+);dichloride
CID 87485865
bis(carbamothioic S-acid);2,6-ditert-butyl-4-methylphenol
CID 88528140
CID 153384878
CID 153384878
lithium 3,5-ditert-butyl-4-hydroxybenzoate
CID 139788661
2,2-bis(3-tert-butyl-2-hydroxy-5-methylphenyl)propanoic acid
CID 88656141

Frequently Asked Questions

What is the IUPAC name of (3,5-ditert-butyl-4-hydroxyphenyl)-(2,4,6-trimethylphenyl)methanone?
The IUPAC name of (3,5-ditert-butyl-4-hydroxyphenyl)-(2,4,6-trimethylphenyl)methanone (CID 25142145) is (3,5-ditert-butyl-4-hydroxyphenyl)-(2,4,6-trimethylphenyl)methanone.
What is the SMILES notation for (3,5-ditert-butyl-4-hydroxyphenyl)-(2,4,6-trimethylphenyl)methanone?
The canonical SMILES for (3,5-ditert-butyl-4-hydroxyphenyl)-(2,4,6-trimethylphenyl)methanone is Cc1cc(C)c(C(=O)c2cc(C(C)(C)C)c(O)c(C(C)(C)C)c2)c(C)c1.
What is the InChIKey of (3,5-ditert-butyl-4-hydroxyphenyl)-(2,4,6-trimethylphenyl)methanone?
The InChIKey is ZKIHEBGUERGHGT-UHFFFAOYSA-N. The full InChI is InChI=1S/C24H32O2/c1-14-10-15(2)20(16(3)11-14)21(25)17-12-18(23(4,5)6)22(26)19(13-17)24(7,8)9/h10-13,26H,1-9H3.
What are the key properties of (3,5-ditert-butyl-4-hydroxyphenyl)-(2,4,6-trimethylphenyl)methanone?
(3,5-ditert-butyl-4-hydroxyphenyl)-(2,4,6-trimethylphenyl)methanone has a molecular weight of 352.52 g/mol, XLogP of 6.14, 2 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for (3,5-ditert-butyl-4-hydroxyphenyl)-(2,4,6-trimethylphenyl)methanone is sourced from PubChem (CID 25142145), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).