4-[2-(4-hydroxyphenyl)propan-2-yl]-2-methylphenol

C16H18O2 — CID 14389009

IUPAC4-[2-(4-hydroxyphenyl)propan-2-yl]-2-methylphenol
SMILESCc1cc(C(C)(C)c2ccc(O)cc2)ccc1O
InChIInChI=1S/C16H18O2/c1-11-10-13(6-9-15(11)18)16(2,3)12-4-7-14(17)8-5-12/h4-10,17-18H,1-3H3
InChIKeyHFRAJYYHALXFLZ-UHFFFAOYSA-N
MW242.32 g/mol
LogP3.73
Rot. Bonds2

About 4-[2-(4-hydroxyphenyl)propan-2-yl]-2-methylphenol

4-[2-(4-hydroxyphenyl)propan-2-yl]-2-methylphenol (PubChem CID 14389009) has the molecular formula C16H18O2 and a molecular weight of 242.32 g/mol. Its IUPAC name is 4-[2-(4-hydroxyphenyl)propan-2-yl]-2-methylphenol.

Molecular Properties

Compound Name4-[2-(4-hydroxyphenyl)propan-2-yl]-2-methylphenol
PubChem CID14389009
Molecular FormulaC16H18O2
Molecular Weight242.32 g/mol
Exact Mass242.13
IUPAC Name4-[2-(4-hydroxyphenyl)propan-2-yl]-2-methylphenol
SMILESCc1cc(C(C)(C)c2ccc(O)cc2)ccc1O
InChIInChI=1S/C16H18O2/c1-11-10-13(6-9-15(11)18)16(2,3)12-4-7-14(17)8-5-12/h4-10,17-18H,1-3H3
InChIKeyHFRAJYYHALXFLZ-UHFFFAOYSA-N
XLogP3.73
TPSA40.46 Ų
H-Bond Donors2
H-Bond Acceptors2
Rotatable Bonds2
Heavy Atoms18
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500242.32
LogP ≤ 53.73
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 102

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Related Compounds

4-[2-(4-hydroxy-3-methylphenyl)propan-2-yl]-2-methylphenol;4-[2-[4-[2-(4-hydroxyphenyl)propan-2-yl]phenyl]propan-2-yl]phenol
CID 130296994
4-[2-(4-hydroxy-3-methylphenyl)propan-2-yl]-2,6-dimethylphenol;4-[2-(4-hydroxyphenyl)propan-2-yl]-2,6-dimethylphenol
CID 67024119
4-[1-(4-hydroxy-3-methylphenyl)-1-[4-[2-(4-hydroxyphenyl)propan-2-yl]phenyl]ethyl]-2-methylphenol
CID 22392546
carbanide;4-[2-(4-hydroxy-3-methylphenyl)propan-2-yl]-2-methylphenol;yttrium
CID 169320278
4-[2-[3-[2-(4-hydroxy-3-methylphenyl)propan-2-yl]phenyl]propan-2-yl]-2-methylphenol
CID 23033100
4-[2-[3-tert-butyl-5-[2-(4-hydroxy-3-methylphenyl)propan-2-yl]phenyl]propan-2-yl]-2-methylphenol
CID 144899041
4-[2-[4-[2-(4-hydroxyphenyl)(1,3-13C2)propan-2-yl]phenyl](1,3-13C2)propan-2-yl]phenol
CID 139024042
4-[2-(4-hydroxy-3-methylphenyl)propan-2-yl]benzene-1,3-diol
CID 139838635
2,6-dimethylphenol;4-[2-(4-hydroxy-3-methylphenyl)propan-2-yl]-2-methylphenol
CID 141474948
benzene-1,3,5-triol;4-[2-(4-hydroxyphenyl)propan-2-yl]phenol
CID 159326359
disodium bisphenol-A
CID 66941220
4-[2-(4-hydroxyphenyl)propan-2-yl]phenol;silver
CID 118588949

Frequently Asked Questions

What is the IUPAC name of 4-[2-(4-hydroxyphenyl)propan-2-yl]-2-methylphenol?
The IUPAC name of 4-[2-(4-hydroxyphenyl)propan-2-yl]-2-methylphenol (CID 14389009) is 4-[2-(4-hydroxyphenyl)propan-2-yl]-2-methylphenol.
What is the SMILES notation for 4-[2-(4-hydroxyphenyl)propan-2-yl]-2-methylphenol?
The canonical SMILES for 4-[2-(4-hydroxyphenyl)propan-2-yl]-2-methylphenol is Cc1cc(C(C)(C)c2ccc(O)cc2)ccc1O.
What is the InChIKey of 4-[2-(4-hydroxyphenyl)propan-2-yl]-2-methylphenol?
The InChIKey is HFRAJYYHALXFLZ-UHFFFAOYSA-N. The full InChI is InChI=1S/C16H18O2/c1-11-10-13(6-9-15(11)18)16(2,3)12-4-7-14(17)8-5-12/h4-10,17-18H,1-3H3.
What are the key properties of 4-[2-(4-hydroxyphenyl)propan-2-yl]-2-methylphenol?
4-[2-(4-hydroxyphenyl)propan-2-yl]-2-methylphenol has a molecular weight of 242.32 g/mol, XLogP of 3.73, 2 rotatable bonds, 2 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 4-[2-(4-hydroxyphenyl)propan-2-yl]-2-methylphenol is sourced from PubChem (CID 14389009), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).