2-diphenylsilylethanethiol

C14H16SSi — CID 173443677

IUPAC2-diphenylsilylethanethiol
SMILESSCC[SiH](c1ccccc1)c1ccccc1
InChIInChI=1S/C14H16SSi/c15-11-12-16(13-7-3-1-4-8-13)14-9-5-2-6-10-14/h1-10,15-16H,11-12H2
InChIKeyPIGOBOPZWPTJTR-UHFFFAOYSA-N
MW244.44 g/mol
LogP1.96
Rot. Bonds4

About 2-diphenylsilylethanethiol

2-diphenylsilylethanethiol (PubChem CID 173443677) has the molecular formula C14H16SSi and a molecular weight of 244.44 g/mol. Its IUPAC name is 2-diphenylsilylethanethiol.

Molecular Properties

Compound Name2-diphenylsilylethanethiol
PubChem CID173443677
Molecular FormulaC14H16SSi
Molecular Weight244.44 g/mol
Exact Mass244.07
IUPAC Name2-diphenylsilylethanethiol
SMILESSCC[SiH](c1ccccc1)c1ccccc1
InChIInChI=1S/C14H16SSi/c15-11-12-16(13-7-3-1-4-8-13)14-9-5-2-6-10-14/h1-10,15-16H,11-12H2
InChIKeyPIGOBOPZWPTJTR-UHFFFAOYSA-N
XLogP1.96
TPSA0.00 Ų
H-Bond Donors1
H-Bond Acceptors1
Rotatable Bonds4
Heavy Atoms16
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500244.44
LogP ≤ 51.96
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 101

Computed Properties (RDKit)

Structural Alerts{'alert_name': 'heavy_metal', 'substructure': 'N/A'}, {'alert_name': 'thiol_2', 'substructure': 'N/A'}

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Related Compounds

3-diphenylsilylpropanenitrile
CID 123721603
hexyl(diphenyl)silane
CID 15142320
3-(2-chlorophenyl)propyl-diphenylsilane
CID 3425752
ethyl-(4-methylphenyl)-phenylsilane
CID 175412827
2-methylbut-2-enyl(diphenyl)silane
CID 123896377
benzene;ethane-1,2-dithiol
CID 21400169
azane;[chloro(phenyl)silyl]methanamine
CID 174569945
[1-chloroethyl(phenyl)silyl]methanamine
CID 174669354
ethyl-[ethyl(phenyl)silyl]-phenylsilane
CID 123339883
bromo(diphenyl)silane
CID 102303968
diphenylsilylphosphane
CID 123635093
hydroxy-phenyl-propylsilane
CID 123207538

Frequently Asked Questions

What is the IUPAC name of 2-diphenylsilylethanethiol?
The IUPAC name of 2-diphenylsilylethanethiol (CID 173443677) is 2-diphenylsilylethanethiol.
What is the SMILES notation for 2-diphenylsilylethanethiol?
The canonical SMILES for 2-diphenylsilylethanethiol is SCC[SiH](c1ccccc1)c1ccccc1.
What is the InChIKey of 2-diphenylsilylethanethiol?
The InChIKey is PIGOBOPZWPTJTR-UHFFFAOYSA-N. The full InChI is InChI=1S/C14H16SSi/c15-11-12-16(13-7-3-1-4-8-13)14-9-5-2-6-10-14/h1-10,15-16H,11-12H2.
What are the key properties of 2-diphenylsilylethanethiol?
2-diphenylsilylethanethiol has a molecular weight of 244.44 g/mol, XLogP of 1.96, 4 rotatable bonds, 1 hydrogen bond donors, and 1 hydrogen bond acceptors.
Where does this data come from?
All data for 2-diphenylsilylethanethiol is sourced from PubChem (CID 173443677), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).