1-[4-[4-(1-hydroxy-2-methylpropyl)phenyl]phenyl]-2-methylpropan-1-ol

C20H26O2 — CID 154573668

IUPAC1-[4-[4-(1-hydroxy-2-methylpropyl)phenyl]phenyl]-2-methylpropan-1-ol
SMILESCC(C)C(O)c1ccc(-c2ccc(C(O)C(C)C)cc2)cc1
InChIInChI=1S/C20H26O2/c1-13(2)19(21)17-9-5-15(6-10-17)16-7-11-18(12-8-16)20(22)14(3)4/h5-14,19-22H,1-4H3
InChIKeyRYHAHJQRABBIER-UHFFFAOYSA-N
MW298.43 g/mol
LogP4.73
Rot. Bonds5

About 1-[4-[4-(1-hydroxy-2-methylpropyl)phenyl]phenyl]-2-methylpropan-1-ol

1-[4-[4-(1-hydroxy-2-methylpropyl)phenyl]phenyl]-2-methylpropan-1-ol (PubChem CID 154573668) has the molecular formula C20H26O2 and a molecular weight of 298.43 g/mol. Its IUPAC name is 1-[4-[4-(1-hydroxy-2-methylpropyl)phenyl]phenyl]-2-methylpropan-1-ol.

Molecular Properties

Compound Name1-[4-[4-(1-hydroxy-2-methylpropyl)phenyl]phenyl]-2-methylpropan-1-ol
PubChem CID154573668
Molecular FormulaC20H26O2
Molecular Weight298.43 g/mol
Exact Mass298.19
IUPAC Name1-[4-[4-(1-hydroxy-2-methylpropyl)phenyl]phenyl]-2-methylpropan-1-ol
SMILESCC(C)C(O)c1ccc(-c2ccc(C(O)C(C)C)cc2)cc1
InChIInChI=1S/C20H26O2/c1-13(2)19(21)17-9-5-15(6-10-17)16-7-11-18(12-8-16)20(22)14(3)4/h5-14,19-22H,1-4H3
InChIKeyRYHAHJQRABBIER-UHFFFAOYSA-N
XLogP4.73
TPSA40.46 Ų
H-Bond Donors2
H-Bond Acceptors2
Rotatable Bonds5
Heavy Atoms22
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500298.43
LogP ≤ 54.73
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 102

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Related Compounds

2-methyl-1-(4-sulfanylphenyl)propan-1-ol
CID 123891512
1-[4-[4-(1-hydroxy-2-methylpropyl)phenoxy]phenyl]-2-methylpropan-1-ol
CID 70467453
2-methyl-1-phenylpropan-1-ol;uranium
CID 59298773
2-[hydroxy-(4-phenylphenyl)methyl]-3-methylbutanoic acid
CID 62396839
2-methyl-1-[4-[(2-methylpropan-2-yl)oxy]phenyl]propan-1-ol
CID 22486849
2,2-difluoro-1-[4-(4-methylphenyl)phenyl]ethanol
CID 159994137
2-methyl-1-[4-[4-(4-prop-2-enylcyclohexyl)phenyl]phenyl]propan-1-ol
CID 67822720
3-hydroxy-2-methyl-3-(4-phenylphenyl)propanenitrile
CID 79136873
2-methyl-1-(3-propan-2-ylphenyl)propan-1-ol
CID 22486943
2-methyl-1-[4-(2-methyl-1,3-dioxolan-2-yl)phenyl]propan-1-ol
CID 169444375
(1S)-2-methyl-1-[4-(4,4,5,5-tetramethyl-1,3,2-dioxaborolan-2-yl)phenyl]propan-1-ol
CID 99773336
3-hydroxy-2,4-dimethyl-1-(4-phenylphenyl)pentan-1-one
CID 134942515

Frequently Asked Questions

What is the IUPAC name of 1-[4-[4-(1-hydroxy-2-methylpropyl)phenyl]phenyl]-2-methylpropan-1-ol?
The IUPAC name of 1-[4-[4-(1-hydroxy-2-methylpropyl)phenyl]phenyl]-2-methylpropan-1-ol (CID 154573668) is 1-[4-[4-(1-hydroxy-2-methylpropyl)phenyl]phenyl]-2-methylpropan-1-ol.
What is the SMILES notation for 1-[4-[4-(1-hydroxy-2-methylpropyl)phenyl]phenyl]-2-methylpropan-1-ol?
The canonical SMILES for 1-[4-[4-(1-hydroxy-2-methylpropyl)phenyl]phenyl]-2-methylpropan-1-ol is CC(C)C(O)c1ccc(-c2ccc(C(O)C(C)C)cc2)cc1.
What is the InChIKey of 1-[4-[4-(1-hydroxy-2-methylpropyl)phenyl]phenyl]-2-methylpropan-1-ol?
The InChIKey is RYHAHJQRABBIER-UHFFFAOYSA-N. The full InChI is InChI=1S/C20H26O2/c1-13(2)19(21)17-9-5-15(6-10-17)16-7-11-18(12-8-16)20(22)14(3)4/h5-14,19-22H,1-4H3.
What are the key properties of 1-[4-[4-(1-hydroxy-2-methylpropyl)phenyl]phenyl]-2-methylpropan-1-ol?
1-[4-[4-(1-hydroxy-2-methylpropyl)phenyl]phenyl]-2-methylpropan-1-ol has a molecular weight of 298.43 g/mol, XLogP of 4.73, 5 rotatable bonds, 2 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 1-[4-[4-(1-hydroxy-2-methylpropyl)phenyl]phenyl]-2-methylpropan-1-ol is sourced from PubChem (CID 154573668), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).