2,2,3-trimethyl-5-phenyl-3H-oxasilole

C12H16OSi — CID 101442946

IUPAC2,2,3-trimethyl-5-phenyl-3H-oxasilole
SMILESCC1C=C(c2ccccc2)O[Si]1(C)C
InChIInChI=1S/C12H16OSi/c1-10-9-12(13-14(10,2)3)11-7-5-4-6-8-11/h4-10H,1-3H3
InChIKeyUNMBYRVMPYARTJ-UHFFFAOYSA-N
MW204.35 g/mol
LogP3.65
Rot. Bonds1

About 2,2,3-trimethyl-5-phenyl-3H-oxasilole

2,2,3-trimethyl-5-phenyl-3H-oxasilole (PubChem CID 101442946) has the molecular formula C12H16OSi and a molecular weight of 204.35 g/mol. Its IUPAC name is 2,2,3-trimethyl-5-phenyl-3H-oxasilole.

Molecular Properties

Compound Name2,2,3-trimethyl-5-phenyl-3H-oxasilole
PubChem CID101442946
Molecular FormulaC12H16OSi
Molecular Weight204.35 g/mol
Exact Mass204.10
IUPAC Name2,2,3-trimethyl-5-phenyl-3H-oxasilole
SMILESCC1C=C(c2ccccc2)O[Si]1(C)C
InChIInChI=1S/C12H16OSi/c1-10-9-12(13-14(10,2)3)11-7-5-4-6-8-11/h4-10H,1-3H3
InChIKeyUNMBYRVMPYARTJ-UHFFFAOYSA-N
XLogP3.65
TPSA9.23 Ų
H-Bond Donors
H-Bond Acceptors1
Rotatable Bonds1
Heavy Atoms14
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500204.35
LogP ≤ 53.65
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

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benzene;1,1'-biphenyl;ethane
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ethane;1,1,2,5-tetramethyl-3,4-diphenylsilole
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benzene;tris(1,1'-biphenyl)
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(2,6-diphenyl-4H-thiopyran-4-yl)-trimethylsilane
CID 12887587
6-iodo-3-methyl-5-phenyl-2,3-dihydropyridine
CID 163958726
3-methyl-2-methylidene-5-phenyl-1,3-oxazole
CID 54340912
1,1'-biphenyl;ethane;hydrobromide
CID 90342014
1,4-bis[4-[4-[4-(4-phenylphenyl)phenyl]phenyl]phenyl]benzene;ethane;1-phenyl-4-[4-[4-[4-[4-[4-[4-[4-[4-(4-phenylphenyl)phenyl]phenyl]phenyl]phenyl]phenyl]phenyl]phenyl]phenyl]benzene
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benzene;1,1'-biphenyl;ethane;methane
CID 161215689

Frequently Asked Questions

What is the IUPAC name of 2,2,3-trimethyl-5-phenyl-3H-oxasilole?
The IUPAC name of 2,2,3-trimethyl-5-phenyl-3H-oxasilole (CID 101442946) is 2,2,3-trimethyl-5-phenyl-3H-oxasilole.
What is the SMILES notation for 2,2,3-trimethyl-5-phenyl-3H-oxasilole?
The canonical SMILES for 2,2,3-trimethyl-5-phenyl-3H-oxasilole is CC1C=C(c2ccccc2)O[Si]1(C)C.
What is the InChIKey of 2,2,3-trimethyl-5-phenyl-3H-oxasilole?
The InChIKey is UNMBYRVMPYARTJ-UHFFFAOYSA-N. The full InChI is InChI=1S/C12H16OSi/c1-10-9-12(13-14(10,2)3)11-7-5-4-6-8-11/h4-10H,1-3H3.
What are the key properties of 2,2,3-trimethyl-5-phenyl-3H-oxasilole?
2,2,3-trimethyl-5-phenyl-3H-oxasilole has a molecular weight of 204.35 g/mol, XLogP of 3.65, 1 rotatable bonds, 0 hydrogen bond donors, and 1 hydrogen bond acceptors.
Where does this data come from?
All data for 2,2,3-trimethyl-5-phenyl-3H-oxasilole is sourced from PubChem (CID 101442946), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).