trimethyl-(5-oxothianthren-1-yl)silane

C15H16OS2Si — CID 102323071

IUPACtrimethyl-(5-oxothianthren-1-yl)silane
SMILESC[Si](C)(C)c1cccc2c1Sc1ccccc1S2=O
InChIInChI=1S/C15H16OS2Si/c1-19(2,3)14-10-6-9-13-15(14)17-11-7-4-5-8-12(11)18(13)16/h4-10H,1-3H3
InChIKeyRQALIUIKPDZVSS-UHFFFAOYSA-N
MW304.51 g/mol
LogP3.86
Rot. Bonds1

About trimethyl-(5-oxothianthren-1-yl)silane

trimethyl-(5-oxothianthren-1-yl)silane (PubChem CID 102323071) has the molecular formula C15H16OS2Si and a molecular weight of 304.51 g/mol. Its IUPAC name is trimethyl-(5-oxothianthren-1-yl)silane.

Molecular Properties

Compound Nametrimethyl-(5-oxothianthren-1-yl)silane
PubChem CID102323071
Molecular FormulaC15H16OS2Si
Molecular Weight304.51 g/mol
Exact Mass304.04
IUPAC Nametrimethyl-(5-oxothianthren-1-yl)silane
SMILESC[Si](C)(C)c1cccc2c1Sc1ccccc1S2=O
InChIInChI=1S/C15H16OS2Si/c1-19(2,3)14-10-6-9-13-15(14)17-11-7-4-5-8-12(11)18(13)16/h4-10H,1-3H3
InChIKeyRQALIUIKPDZVSS-UHFFFAOYSA-N
XLogP3.86
TPSA17.07 Ų
H-Bond Donors
H-Bond Acceptors2
Rotatable Bonds1
Heavy Atoms19
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500304.51
LogP ≤ 53.86
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

(5,10-dioxo-6-trimethylsilylthianthren-1-yl)-trimethylsilane
CID 102471459
acetic acid;thianthrene;thianthrene 5-oxide
CID 159806519
trimethyl-(2-trimethylsilylphenyl)silane
CID 519794
25,26,27,28-tetrapropoxy-2λ4,8λ4,14,20-tetrathiapentacyclo[19.3.1.13,7.19,13.115,19]octacosa-1(24),3(28),4,6,9,11,13(27),15,17,19(26),21(25),22-dodecaene 2,8-dioxide
CID 132504378
dibenzothiophene 5-oxide
CID 13898
lithium 2-trimethylsilylbenzenethiolate
CID 11106118
trimethyl-(2-triphenylsilylphenyl)silane
CID 91070759
2,7-dimethylthianthrene 5-oxide
CID 142700843
2-methoxy-7-thiabicyclo[4.1.0]hepta-1,3,5-triene
CID 172854405
(3,16-dimethyl-8-thia-3-azoniatetracyclo[7.7.1.02,7.013,17]heptadeca-1(16),2,4,6,9,11,13(17),14-octaen-6-yl)-trimethylsilane
CID 166053558
ethane;methyl 10-oxo-9H-thioxanthene-4-carboxylate;methyl 9H-thioxanthene-4-carboxylate
CID 163908200
(2-trimethylsilylphenyl) acetate
CID 13101762

Frequently Asked Questions

What is the IUPAC name of trimethyl-(5-oxothianthren-1-yl)silane?
The IUPAC name of trimethyl-(5-oxothianthren-1-yl)silane (CID 102323071) is trimethyl-(5-oxothianthren-1-yl)silane.
What is the SMILES notation for trimethyl-(5-oxothianthren-1-yl)silane?
The canonical SMILES for trimethyl-(5-oxothianthren-1-yl)silane is C[Si](C)(C)c1cccc2c1Sc1ccccc1S2=O.
What is the InChIKey of trimethyl-(5-oxothianthren-1-yl)silane?
The InChIKey is RQALIUIKPDZVSS-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H16OS2Si/c1-19(2,3)14-10-6-9-13-15(14)17-11-7-4-5-8-12(11)18(13)16/h4-10H,1-3H3.
What are the key properties of trimethyl-(5-oxothianthren-1-yl)silane?
trimethyl-(5-oxothianthren-1-yl)silane has a molecular weight of 304.51 g/mol, XLogP of 3.86, 1 rotatable bonds, 0 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for trimethyl-(5-oxothianthren-1-yl)silane is sourced from PubChem (CID 102323071), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).