1-ethenyl-2-methylbenzene;1,1,2-trimethylsilinane

C17H28Si — CID 174747704

IUPAC1-ethenyl-2-methylbenzene;1,1,2-trimethylsilinane
SMILESC=Cc1ccccc1C.CC1CCCC[Si]1(C)C
InChIInChI=1S/C9H10.C8H18Si/c1-3-9-7-5-4-6-8(9)2;1-8-6-4-5-7-9(8,2)3/h3-7H,1H2,2H3;8H,4-7H2,1-3H3
InChIKeyXTWJWWBRNLNOLX-UHFFFAOYSA-N
MW260.50 g/mol
LogP5.91
Rot. Bonds1

About 1-ethenyl-2-methylbenzene;1,1,2-trimethylsilinane

1-ethenyl-2-methylbenzene;1,1,2-trimethylsilinane (PubChem CID 174747704) has the molecular formula C17H28Si and a molecular weight of 260.50 g/mol. Its IUPAC name is 1-ethenyl-2-methylbenzene;1,1,2-trimethylsilinane.

Molecular Properties

Compound Name1-ethenyl-2-methylbenzene;1,1,2-trimethylsilinane
PubChem CID174747704
Molecular FormulaC17H28Si
Molecular Weight260.50 g/mol
Exact Mass260.20
IUPAC Name1-ethenyl-2-methylbenzene;1,1,2-trimethylsilinane
SMILESC=Cc1ccccc1C.CC1CCCC[Si]1(C)C
InChIInChI=1S/C9H10.C8H18Si/c1-3-9-7-5-4-6-8(9)2;1-8-6-4-5-7-9(8,2)3/h3-7H,1H2,2H3;8H,4-7H2,1-3H3
InChIKeyXTWJWWBRNLNOLX-UHFFFAOYSA-N
XLogP5.91
TPSA0.00 Ų
H-Bond Donors
H-Bond Acceptors
Rotatable Bonds1
Heavy Atoms18
Complexity—

Lipinski Rule of Five

1 violation

RuleValue
MW ≤ 500260.50
LogP ≤ 55.91
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 100

Computed Properties (RDKit)

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

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Related Compounds

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CID 174828850
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CID 174441225
1-ethenyl-2-methylbenzene;trimethylazanium
CID 18465530
carbanide;titanium;1,1,2-trimethylsilinane
CID 174291165
ethenoxyethene;1-ethenyl-2-methylbenzene
CID 175558522
1-phenylpiperidine;1,1,2-trimethylsilinane
CID 174570050
ethane;ethene;1-ethenyl-2-methylbenzene;propane
CID 142045416
1-ethenyl-2-methylbenzene;2-methylprop-1-ene;hydrobromide
CID 174713948
1-ethenyl-2-methylbenzene;heptane
CID 173354339
1-ethenyl-2-ethyl-4-methylbenzene;1-ethenyl-2-methylbenzene
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1-ethenyl-2-methylbenzene;2-methyl-2-phenyloxirane
CID 178075043

Frequently Asked Questions

What is the IUPAC name of 1-ethenyl-2-methylbenzene;1,1,2-trimethylsilinane?
The IUPAC name of 1-ethenyl-2-methylbenzene;1,1,2-trimethylsilinane (CID 174747704) is 1-ethenyl-2-methylbenzene;1,1,2-trimethylsilinane.
What is the SMILES notation for 1-ethenyl-2-methylbenzene;1,1,2-trimethylsilinane?
The canonical SMILES for 1-ethenyl-2-methylbenzene;1,1,2-trimethylsilinane is C=Cc1ccccc1C.CC1CCCC[Si]1(C)C.
What is the InChIKey of 1-ethenyl-2-methylbenzene;1,1,2-trimethylsilinane?
The InChIKey is XTWJWWBRNLNOLX-UHFFFAOYSA-N. The full InChI is InChI=1S/C9H10.C8H18Si/c1-3-9-7-5-4-6-8(9)2;1-8-6-4-5-7-9(8,2)3/h3-7H,1H2,2H3;8H,4-7H2,1-3H3.
What are the key properties of 1-ethenyl-2-methylbenzene;1,1,2-trimethylsilinane?
1-ethenyl-2-methylbenzene;1,1,2-trimethylsilinane has a molecular weight of 260.50 g/mol, XLogP of 5.91, 1 rotatable bonds, 0 hydrogen bond donors, and 0 hydrogen bond acceptors.
Where does this data come from?
All data for 1-ethenyl-2-methylbenzene;1,1,2-trimethylsilinane is sourced from PubChem (CID 174747704), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).