4-[(2-methylpropan-2-yl)oxy]phenol

C10H14O2 — CID 2773621

IUPAC4-[(2-methylpropan-2-yl)oxy]phenol
SMILESCC(C)(C)Oc1ccc(O)cc1
InChIInChI=1S/C10H14O2/c1-10(2,3)12-9-6-4-8(11)5-7-9/h4-7,11H,1-3H3
InChIKeyCIICLJLSRUHUBY-UHFFFAOYSA-N
MW166.22 g/mol
LogP2.57
Rot. Bonds1

About 4-[(2-methylpropan-2-yl)oxy]phenol

4-[(2-methylpropan-2-yl)oxy]phenol (PubChem CID 2773621) has the molecular formula C10H14O2 and a molecular weight of 166.22 g/mol. Its IUPAC name is 4-[(2-methylpropan-2-yl)oxy]phenol.

Molecular Properties

Compound Name4-[(2-methylpropan-2-yl)oxy]phenol
PubChem CID2773621
Molecular FormulaC10H14O2
Molecular Weight166.22 g/mol
Exact Mass166.10
IUPAC Name4-[(2-methylpropan-2-yl)oxy]phenol
SMILESCC(C)(C)Oc1ccc(O)cc1
InChIInChI=1S/C10H14O2/c1-10(2,3)12-9-6-4-8(11)5-7-9/h4-7,11H,1-3H3
InChIKeyCIICLJLSRUHUBY-UHFFFAOYSA-N
XLogP2.57
TPSA29.46 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds1
Heavy Atoms12
Complexity

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500166.22
LogP ≤ 52.57
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

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Frequently Asked Questions

What is the IUPAC name of 4-[(2-methylpropan-2-yl)oxy]phenol?
The IUPAC name of 4-[(2-methylpropan-2-yl)oxy]phenol (CID 2773621) is 4-[(2-methylpropan-2-yl)oxy]phenol.
What is the SMILES notation for 4-[(2-methylpropan-2-yl)oxy]phenol?
The canonical SMILES for 4-[(2-methylpropan-2-yl)oxy]phenol is CC(C)(C)Oc1ccc(O)cc1.
What is the InChIKey of 4-[(2-methylpropan-2-yl)oxy]phenol?
The InChIKey is CIICLJLSRUHUBY-UHFFFAOYSA-N. The full InChI is InChI=1S/C10H14O2/c1-10(2,3)12-9-6-4-8(11)5-7-9/h4-7,11H,1-3H3.
What are the key properties of 4-[(2-methylpropan-2-yl)oxy]phenol?
4-[(2-methylpropan-2-yl)oxy]phenol has a molecular weight of 166.22 g/mol, XLogP of 2.57, 1 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 4-[(2-methylpropan-2-yl)oxy]phenol is sourced from PubChem (CID 2773621), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).