di(propan-2-yloxy)silyloxymethanethiol

C7H18O3SSi — CID 175385220

IUPACdi(propan-2-yloxy)silyloxymethanethiol
SMILESCC(C)O[SiH](OCS)OC(C)C
InChIInChI=1S/C7H18O3SSi/c1-6(2)9-12(8-5-11)10-7(3)4/h6-7,11-12H,5H2,1-4H3
InChIKeyUHHUNTMOEZFYST-UHFFFAOYSA-N
MW210.37 g/mol
LogP1.46
Rot. Bonds6

About di(propan-2-yloxy)silyloxymethanethiol

di(propan-2-yloxy)silyloxymethanethiol (PubChem CID 175385220) has the molecular formula C7H18O3SSi and a molecular weight of 210.37 g/mol. Its IUPAC name is di(propan-2-yloxy)silyloxymethanethiol.

Molecular Properties

Compound Namedi(propan-2-yloxy)silyloxymethanethiol
PubChem CID175385220
Molecular FormulaC7H18O3SSi
Molecular Weight210.37 g/mol
Exact Mass210.07
IUPAC Namedi(propan-2-yloxy)silyloxymethanethiol
SMILESCC(C)O[SiH](OCS)OC(C)C
InChIInChI=1S/C7H18O3SSi/c1-6(2)9-12(8-5-11)10-7(3)4/h6-7,11-12H,5H2,1-4H3
InChIKeyUHHUNTMOEZFYST-UHFFFAOYSA-N
XLogP1.46
TPSA27.69 Ų
H-Bond Donors1
H-Bond Acceptors4
Rotatable Bonds6
Heavy Atoms12
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500210.37
LogP ≤ 51.46
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 104

Computed Properties (RDKit)

Structural Alerts{'alert_name': 'heavy_metal', 'substructure': 'N/A'}, {'alert_name': 'het-C-het_not_in_ring', 'substructure': 'N/A'}, {'alert_name': 'thiol_2', 'substructure': 'N/A'}

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Related Compounds

di(propan-2-yloxy)silylmethanethiol
CID 175385218
octadecoxy-di(propan-2-yloxy)silane
CID 175421908
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
magnesium;carbanide;dimethyl(propan-2-yloxy)silane;chloride
CID 161140488
sulfane;triethoxysilane
CID 173007277
magnesium;di(propan-2-yloxy)-propylsilane;iodide
CID 59537815
di(propan-2-yloxy)silyl 2-methylidenehexanoate
CID 173111713
chloro-methoxy-propan-2-yloxysilane
CID 151511700
tris(2,6-dimethylheptan-4-yloxy)silane
CID 175859767
ethenyl-di(propan-2-yloxy)silane
CID 123164903

Frequently Asked Questions

What is the IUPAC name of di(propan-2-yloxy)silyloxymethanethiol?
The IUPAC name of di(propan-2-yloxy)silyloxymethanethiol (CID 175385220) is di(propan-2-yloxy)silyloxymethanethiol.
What is the SMILES notation for di(propan-2-yloxy)silyloxymethanethiol?
The canonical SMILES for di(propan-2-yloxy)silyloxymethanethiol is CC(C)O[SiH](OCS)OC(C)C.
What is the InChIKey of di(propan-2-yloxy)silyloxymethanethiol?
The InChIKey is UHHUNTMOEZFYST-UHFFFAOYSA-N. The full InChI is InChI=1S/C7H18O3SSi/c1-6(2)9-12(8-5-11)10-7(3)4/h6-7,11-12H,5H2,1-4H3.
What are the key properties of di(propan-2-yloxy)silyloxymethanethiol?
di(propan-2-yloxy)silyloxymethanethiol has a molecular weight of 210.37 g/mol, XLogP of 1.46, 6 rotatable bonds, 1 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for di(propan-2-yloxy)silyloxymethanethiol is sourced from PubChem (CID 175385220), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).