(4-methylphenyl)-trimethylsilylmethanone

C11H16OSi — CID 3464459

IUPAC(4-methylphenyl)-trimethylsilylmethanone
SMILESCc1ccc(C(=O)[Si](C)(C)C)cc1
InChIInChI=1S/C11H16OSi/c1-9-5-7-10(8-6-9)11(12)13(2,3)4/h5-8H,1-4H3
InChIKeyNHUCUMVBYJUDLI-UHFFFAOYSA-N
MW192.33 g/mol
LogP3.06
Rot. Bonds2

About (4-methylphenyl)-trimethylsilylmethanone

(4-methylphenyl)-trimethylsilylmethanone (PubChem CID 3464459) has the molecular formula C11H16OSi and a molecular weight of 192.33 g/mol. Its IUPAC name is (4-methylphenyl)-trimethylsilylmethanone.

Molecular Properties

Compound Name(4-methylphenyl)-trimethylsilylmethanone
PubChem CID3464459
Molecular FormulaC11H16OSi
Molecular Weight192.33 g/mol
Exact Mass192.10
IUPAC Name(4-methylphenyl)-trimethylsilylmethanone
SMILESCc1ccc(C(=O)[Si](C)(C)C)cc1
InChIInChI=1S/C11H16OSi/c1-9-5-7-10(8-6-9)11(12)13(2,3)4/h5-8H,1-4H3
InChIKeyNHUCUMVBYJUDLI-UHFFFAOYSA-N
XLogP3.06
TPSA17.07 Ų
H-Bond Donors
H-Bond Acceptors1
Rotatable Bonds2
Heavy Atoms13
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500192.33
LogP ≤ 53.06
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 101

Computed Properties (RDKit)

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

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Related Compounds

[diethoxy-(4-methylbenzoyl)silyl]-(4-methylphenyl)methanone
CID 19902442
alumane;4-methylbenzoic acid
CID 173230362
CID 158355468
CID 158355468
indigane;4-methylbenzoic acid
CID 173230327
4-methylbenzoyl chloride
CID 13405
1-(4-methylphenyl)ethanone;hydrochloride
CID 172692328
ethane;4-methylbenzoyl iodide
CID 142151570
sodium 4-methylbenzoic acid
CID 164511663
carbonic acid;1,4-xylene
CID 89415214
mercury(2+);bis(4-methylbenzoate)
CID 22604467
gadolinium(3+);tris(4-methylbenzoate)
CID 159199337
(Z)-1,2,3,4-tetrakis(4-methylphenyl)but-2-ene-1,4-dione
CID 12516207

Frequently Asked Questions

What is the IUPAC name of (4-methylphenyl)-trimethylsilylmethanone?
The IUPAC name of (4-methylphenyl)-trimethylsilylmethanone (CID 3464459) is (4-methylphenyl)-trimethylsilylmethanone.
What is the SMILES notation for (4-methylphenyl)-trimethylsilylmethanone?
The canonical SMILES for (4-methylphenyl)-trimethylsilylmethanone is Cc1ccc(C(=O)[Si](C)(C)C)cc1.
What is the InChIKey of (4-methylphenyl)-trimethylsilylmethanone?
The InChIKey is NHUCUMVBYJUDLI-UHFFFAOYSA-N. The full InChI is InChI=1S/C11H16OSi/c1-9-5-7-10(8-6-9)11(12)13(2,3)4/h5-8H,1-4H3.
What are the key properties of (4-methylphenyl)-trimethylsilylmethanone?
(4-methylphenyl)-trimethylsilylmethanone has a molecular weight of 192.33 g/mol, XLogP of 3.06, 2 rotatable bonds, 0 hydrogen bond donors, and 1 hydrogen bond acceptors.
Where does this data come from?
All data for (4-methylphenyl)-trimethylsilylmethanone is sourced from PubChem (CID 3464459), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).