4-(3-ethyl-2-methyl-6-phenylphenyl)phenol

C21H20O — CID 139603227

IUPAC4-(3-ethyl-2-methyl-6-phenylphenyl)phenol
SMILESCCc1ccc(-c2ccccc2)c(-c2ccc(O)cc2)c1C
InChIInChI=1S/C21H20O/c1-3-16-11-14-20(17-7-5-4-6-8-17)21(15(16)2)18-9-12-19(22)13-10-18/h4-14,22H,3H2,1-2H3
InChIKeyZDUATXMCPSSSJJ-UHFFFAOYSA-N
MW288.39 g/mol
LogP5.60
Rot. Bonds3

About 4-(3-ethyl-2-methyl-6-phenylphenyl)phenol

4-(3-ethyl-2-methyl-6-phenylphenyl)phenol (PubChem CID 139603227) has the molecular formula C21H20O and a molecular weight of 288.39 g/mol. Its IUPAC name is 4-(3-ethyl-2-methyl-6-phenylphenyl)phenol.

Molecular Properties

Compound Name4-(3-ethyl-2-methyl-6-phenylphenyl)phenol
PubChem CID139603227
Molecular FormulaC21H20O
Molecular Weight288.39 g/mol
Exact Mass288.15
IUPAC Name4-(3-ethyl-2-methyl-6-phenylphenyl)phenol
SMILESCCc1ccc(-c2ccccc2)c(-c2ccc(O)cc2)c1C
InChIInChI=1S/C21H20O/c1-3-16-11-14-20(17-7-5-4-6-8-17)21(15(16)2)18-9-12-19(22)13-10-18/h4-14,22H,3H2,1-2H3
InChIKeyZDUATXMCPSSSJJ-UHFFFAOYSA-N
XLogP5.60
TPSA20.23 Ų
H-Bond Donors1
H-Bond Acceptors1
Rotatable Bonds3
Heavy Atoms22
Complexity—

Lipinski Rule of Five

1 violation

RuleValue
MW ≤ 500288.39
LogP ≤ 55.60
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 101

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Related Compounds

1-ethyl-2-methyl-3,4-bis(4-methylphenyl)benzene
CID 173306177
1-ethyl-2,4-dimethyl-3,5-diphenylbenzene
CID 173306034
4-(2,6-diethylphenyl)phenol
CID 21281287
2-methyl-1-pentyl-4-[4-(4-pentylphenyl)phenyl]-3-phenylbenzene
CID 19007996
4-(2,3,4-triethylphenyl)phenol
CID 101302516
ethane;3-ethyl-2-fluoro-6-phenylphenol
CID 145394712
2,6-diethyl-3-phenylphenol
CID 101302345
2-methyl-3,4-diphenylbenzoic acid
CID 118554966
4-ethyl-3-methyl-2-phenylbenzonitrile
CID 98010488
1,4-bis(4-methylphenyl)-2,3-diphenylbenzene
CID 123305097
1-ethyl-2-methylbenzene;4-(4-hydroxyphenyl)phenol
CID 174751633
1,2-diethyl-4-(4-phenoxyphenyl)-3-phenylbenzene
CID 173252545

Frequently Asked Questions

What is the IUPAC name of 4-(3-ethyl-2-methyl-6-phenylphenyl)phenol?
The IUPAC name of 4-(3-ethyl-2-methyl-6-phenylphenyl)phenol (CID 139603227) is 4-(3-ethyl-2-methyl-6-phenylphenyl)phenol.
What is the SMILES notation for 4-(3-ethyl-2-methyl-6-phenylphenyl)phenol?
The canonical SMILES for 4-(3-ethyl-2-methyl-6-phenylphenyl)phenol is CCc1ccc(-c2ccccc2)c(-c2ccc(O)cc2)c1C.
What is the InChIKey of 4-(3-ethyl-2-methyl-6-phenylphenyl)phenol?
The InChIKey is ZDUATXMCPSSSJJ-UHFFFAOYSA-N. The full InChI is InChI=1S/C21H20O/c1-3-16-11-14-20(17-7-5-4-6-8-17)21(15(16)2)18-9-12-19(22)13-10-18/h4-14,22H,3H2,1-2H3.
What are the key properties of 4-(3-ethyl-2-methyl-6-phenylphenyl)phenol?
4-(3-ethyl-2-methyl-6-phenylphenyl)phenol has a molecular weight of 288.39 g/mol, XLogP of 5.60, 3 rotatable bonds, 1 hydrogen bond donors, and 1 hydrogen bond acceptors.
Where does this data come from?
All data for 4-(3-ethyl-2-methyl-6-phenylphenyl)phenol is sourced from PubChem (CID 139603227), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).