(2,3-dimethylphenyl)-[(4-ethenylphenoxy)-dimethylsilyl]methanone

C19H22O2Si — CID 18960351

IUPAC(2,3-dimethylphenyl)-[(4-ethenylphenoxy)-dimethylsilyl]methanone
SMILESC=Cc1ccc(O[Si](C)(C)C(=O)c2cccc(C)c2C)cc1
InChIInChI=1S/C19H22O2Si/c1-6-16-10-12-17(13-11-16)21-22(4,5)19(20)18-9-7-8-14(2)15(18)3/h6-13H,1H2,2-5H3
InChIKeyNVOVZXITLFRFEK-UHFFFAOYSA-N
MW310.47 g/mol
LogP4.95
Rot. Bonds5

About (2,3-dimethylphenyl)-[(4-ethenylphenoxy)-dimethylsilyl]methanone

(2,3-dimethylphenyl)-[(4-ethenylphenoxy)-dimethylsilyl]methanone (PubChem CID 18960351) has the molecular formula C19H22O2Si and a molecular weight of 310.47 g/mol. Its IUPAC name is (2,3-dimethylphenyl)-[(4-ethenylphenoxy)-dimethylsilyl]methanone.

Molecular Properties

Compound Name(2,3-dimethylphenyl)-[(4-ethenylphenoxy)-dimethylsilyl]methanone
PubChem CID18960351
Molecular FormulaC19H22O2Si
Molecular Weight310.47 g/mol
Exact Mass310.14
IUPAC Name(2,3-dimethylphenyl)-[(4-ethenylphenoxy)-dimethylsilyl]methanone
SMILESC=Cc1ccc(O[Si](C)(C)C(=O)c2cccc(C)c2C)cc1
InChIInChI=1S/C19H22O2Si/c1-6-16-10-12-17(13-11-16)21-22(4,5)19(20)18-9-7-8-14(2)15(18)3/h6-13H,1H2,2-5H3
InChIKeyNVOVZXITLFRFEK-UHFFFAOYSA-N
XLogP4.95
TPSA26.30 Ų
H-Bond Donors
H-Bond Acceptors2
Rotatable Bonds5
Heavy Atoms22
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500310.47
LogP ≤ 54.95
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 102

Computed Properties (RDKit)

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

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Related Compounds

[2-(2,3-dimethylphenyl)-2-oxoethyl] 4-ethenylbenzoate
CID 174296006
trimethylsilyl 2,3-dimethylbenzoate
CID 91714654
(4-ethenylphenyl)-dimethyl-phenoxysilane
CID 141499765
(2,3-dimethylphenyl)-(5-methylfuran-3-yl)methanone
CID 114970147
2,3-dimethylbenzoyl iodide
CID 87941796
(4-ethenylphenoxy)-triphenylsilane
CID 18676759
fluoro 2,3-dimethylbenzoate
CID 174427719
O-ethenyl 2,3-dimethylbenzenecarbothioate
CID 54517016
2,3-dimethylbenzamide;ethane
CID 143389789
(4-phenoxyphenyl) 2,3-dimethylbenzoate
CID 7961917
(2-methylphenyl) 4-ethenylbenzoate
CID 101047505
(4-ethenylphenyl) acetate;oxophosphane
CID 175041738

Frequently Asked Questions

What is the IUPAC name of (2,3-dimethylphenyl)-[(4-ethenylphenoxy)-dimethylsilyl]methanone?
The IUPAC name of (2,3-dimethylphenyl)-[(4-ethenylphenoxy)-dimethylsilyl]methanone (CID 18960351) is (2,3-dimethylphenyl)-[(4-ethenylphenoxy)-dimethylsilyl]methanone.
What is the SMILES notation for (2,3-dimethylphenyl)-[(4-ethenylphenoxy)-dimethylsilyl]methanone?
The canonical SMILES for (2,3-dimethylphenyl)-[(4-ethenylphenoxy)-dimethylsilyl]methanone is C=Cc1ccc(O[Si](C)(C)C(=O)c2cccc(C)c2C)cc1.
What is the InChIKey of (2,3-dimethylphenyl)-[(4-ethenylphenoxy)-dimethylsilyl]methanone?
The InChIKey is NVOVZXITLFRFEK-UHFFFAOYSA-N. The full InChI is InChI=1S/C19H22O2Si/c1-6-16-10-12-17(13-11-16)21-22(4,5)19(20)18-9-7-8-14(2)15(18)3/h6-13H,1H2,2-5H3.
What are the key properties of (2,3-dimethylphenyl)-[(4-ethenylphenoxy)-dimethylsilyl]methanone?
(2,3-dimethylphenyl)-[(4-ethenylphenoxy)-dimethylsilyl]methanone has a molecular weight of 310.47 g/mol, XLogP of 4.95, 5 rotatable bonds, 0 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for (2,3-dimethylphenyl)-[(4-ethenylphenoxy)-dimethylsilyl]methanone is sourced from PubChem (CID 18960351), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).