5-methyl-2-propan-2-ylphenol;zinc

C10H14OZn — CID 160855786

IUPAC5-methyl-2-propan-2-ylphenol;zinc
SMILESCc1ccc(C(C)C)c(O)c1.[Zn]
InChIInChI=1S/C10H14O.Zn/c1-7(2)9-5-4-8(3)6-10(9)11;/h4-7,11H,1-3H3;
InChIKeySJVIRBKCPJFXHJ-UHFFFAOYSA-N
MW215.61 g/mol
LogP2.82
Rot. Bonds1

About 5-methyl-2-propan-2-ylphenol;zinc

5-methyl-2-propan-2-ylphenol;zinc (PubChem CID 160855786) has the molecular formula C10H14OZn and a molecular weight of 215.61 g/mol. Its IUPAC name is 5-methyl-2-propan-2-ylphenol;zinc.

Molecular Properties

Compound Name5-methyl-2-propan-2-ylphenol;zinc
PubChem CID160855786
Molecular FormulaC10H14OZn
Molecular Weight215.61 g/mol
Exact Mass214.03
IUPAC Name5-methyl-2-propan-2-ylphenol;zinc
SMILESCc1ccc(C(C)C)c(O)c1.[Zn]
InChIInChI=1S/C10H14O.Zn/c1-7(2)9-5-4-8(3)6-10(9)11;/h4-7,11H,1-3H3;
InChIKeySJVIRBKCPJFXHJ-UHFFFAOYSA-N
XLogP2.82
TPSA20.23 Ų
H-Bond Donors1
H-Bond Acceptors1
Rotatable Bonds1
Heavy Atoms12
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500215.61
LogP ≤ 52.82
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 101

Computed Properties (RDKit)

Structural Alerts{'alert_name': 'heavy_metal', 'substructure': 'N/A'}

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Related Compounds

bis(5-methyl-2-propan-2-ylphenol);dihydroiodide
CID 69164517
cobalt;bis(5-methyl-2-propan-2-ylphenol)
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zinc;5-methyl-2-propan-2-ylphenol;oxygen(2-)
CID 162244199
5-methyl-2-propan-2-ylphenol;phosphoric acid
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5-methyl-2-propan-2-ylphenol;2,3,6-trimethylphenol
CID 70978775
1-methyl-4-propan-2-ylbenzene;2-methyl-5-propan-2-ylphenol;5-methyl-2-propan-2-ylphenol
CID 68551781
decan-1-ol;5-methyl-2-propan-2-ylphenol
CID 158013264
2-(1-amino-2-methylpropyl)-5-methylphenol
CID 55283226
5-methyl-2-propan-2-ylphenol;octan-3-one
CID 69043830
2-[bis(4-methylphenyl)methyl]-5-methylphenol
CID 21115451
5-methyl-2-pentan-3-ylphenol
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potassium 5-methyl-2-propan-2-ylphenolate
CID 23693969

Frequently Asked Questions

What is the IUPAC name of 5-methyl-2-propan-2-ylphenol;zinc?
The IUPAC name of 5-methyl-2-propan-2-ylphenol;zinc (CID 160855786) is 5-methyl-2-propan-2-ylphenol;zinc.
What is the SMILES notation for 5-methyl-2-propan-2-ylphenol;zinc?
The canonical SMILES for 5-methyl-2-propan-2-ylphenol;zinc is Cc1ccc(C(C)C)c(O)c1.[Zn].
What is the InChIKey of 5-methyl-2-propan-2-ylphenol;zinc?
The InChIKey is SJVIRBKCPJFXHJ-UHFFFAOYSA-N. The full InChI is InChI=1S/C10H14O.Zn/c1-7(2)9-5-4-8(3)6-10(9)11;/h4-7,11H,1-3H3;.
What are the key properties of 5-methyl-2-propan-2-ylphenol;zinc?
5-methyl-2-propan-2-ylphenol;zinc has a molecular weight of 215.61 g/mol, XLogP of 2.82, 1 rotatable bonds, 1 hydrogen bond donors, and 1 hydrogen bond acceptors.
Where does this data come from?
All data for 5-methyl-2-propan-2-ylphenol;zinc is sourced from PubChem (CID 160855786), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).