di(propan-2-yloxy)silylmethanethiol

C7H18O2SSi — CID 175385218

IUPACdi(propan-2-yloxy)silylmethanethiol
SMILESCC(C)O[SiH](CS)OC(C)C
InChIInChI=1S/C7H18O2SSi/c1-6(2)8-11(5-10)9-7(3)4/h6-7,10-11H,5H2,1-4H3
InChIKeyISHOCALKZCSWTC-UHFFFAOYSA-N
MW194.37 g/mol
LogP1.53
Rot. Bonds5

About di(propan-2-yloxy)silylmethanethiol

di(propan-2-yloxy)silylmethanethiol (PubChem CID 175385218) has the molecular formula C7H18O2SSi and a molecular weight of 194.37 g/mol. Its IUPAC name is di(propan-2-yloxy)silylmethanethiol.

Molecular Properties

Compound Namedi(propan-2-yloxy)silylmethanethiol
PubChem CID175385218
Molecular FormulaC7H18O2SSi
Molecular Weight194.37 g/mol
Exact Mass194.08
IUPAC Namedi(propan-2-yloxy)silylmethanethiol
SMILESCC(C)O[SiH](CS)OC(C)C
InChIInChI=1S/C7H18O2SSi/c1-6(2)8-11(5-10)9-7(3)4/h6-7,10-11H,5H2,1-4H3
InChIKeyISHOCALKZCSWTC-UHFFFAOYSA-N
XLogP1.53
TPSA18.46 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds5
Heavy Atoms11
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500194.37
LogP ≤ 51.53
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

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

di(propan-2-yloxy)silyloxymethanethiol
CID 175385220
magnesium;di(propan-2-yloxy)-propylsilane;iodide
CID 59537815
diethyl(propan-2-yloxy)silane
CID 59537827
propan-2-yl-di(propan-2-yloxy)silane
CID 123187652
ethyl-[2-[ethyl(propan-2-yloxy)silyl]ethyl]-propan-2-yloxysilane
CID 59537857
di(propan-2-yloxy)-(4,4,4-trifluorobutan-2-yl)silane
CID 173041525
magnesium;carbanide;dimethyl(propan-2-yloxy)silane;chloride
CID 161140488
4-di(propan-2-yloxy)silylbutan-2-yl prop-2-enoate
CID 151879841
ethenyl-di(propan-2-yloxy)silane
CID 123164903
chloro-methoxy-propan-2-yloxysilane
CID 151511700
di(propan-2-yloxy)-prop-1-enylsilane
CID 154087655
octadecoxy-di(propan-2-yloxy)silane
CID 175421908

Frequently Asked Questions

What is the IUPAC name of di(propan-2-yloxy)silylmethanethiol?
The IUPAC name of di(propan-2-yloxy)silylmethanethiol (CID 175385218) is di(propan-2-yloxy)silylmethanethiol.
What is the SMILES notation for di(propan-2-yloxy)silylmethanethiol?
The canonical SMILES for di(propan-2-yloxy)silylmethanethiol is CC(C)O[SiH](CS)OC(C)C.
What is the InChIKey of di(propan-2-yloxy)silylmethanethiol?
The InChIKey is ISHOCALKZCSWTC-UHFFFAOYSA-N. The full InChI is InChI=1S/C7H18O2SSi/c1-6(2)8-11(5-10)9-7(3)4/h6-7,10-11H,5H2,1-4H3.
What are the key properties of di(propan-2-yloxy)silylmethanethiol?
di(propan-2-yloxy)silylmethanethiol has a molecular weight of 194.37 g/mol, XLogP of 1.53, 5 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for di(propan-2-yloxy)silylmethanethiol is sourced from PubChem (CID 175385218), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).