difluoro-methyl-(3-methylsulfonylpropyl)silane

C5H12F2O2SSi — CID 153445078

IUPACdifluoro-methyl-(3-methylsulfonylpropyl)silane
SMILESC[Si](F)(F)CCCS(C)(=O)=O
InChIInChI=1S/C5H12F2O2SSi/c1-10(8,9)4-3-5-11(2,6)7/h3-5H2,1-2H3
InChIKeyIKPIAYYCKADDHS-UHFFFAOYSA-N
MW202.30 g/mol
LogP1.43
Rot. Bonds4

About difluoro-methyl-(3-methylsulfonylpropyl)silane

difluoro-methyl-(3-methylsulfonylpropyl)silane (PubChem CID 153445078) has the molecular formula C5H12F2O2SSi and a molecular weight of 202.30 g/mol. Its IUPAC name is difluoro-methyl-(3-methylsulfonylpropyl)silane.

Molecular Properties

Compound Namedifluoro-methyl-(3-methylsulfonylpropyl)silane
PubChem CID153445078
Molecular FormulaC5H12F2O2SSi
Molecular Weight202.30 g/mol
Exact Mass202.03
IUPAC Namedifluoro-methyl-(3-methylsulfonylpropyl)silane
SMILESC[Si](F)(F)CCCS(C)(=O)=O
InChIInChI=1S/C5H12F2O2SSi/c1-10(8,9)4-3-5-11(2,6)7/h3-5H2,1-2H3
InChIKeyIKPIAYYCKADDHS-UHFFFAOYSA-N
XLogP1.43
TPSA34.14 Ų
H-Bond Donors
H-Bond Acceptors2
Rotatable Bonds4
Heavy Atoms11
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500202.30
LogP ≤ 51.43
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 102

Computed Properties (RDKit)

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

Analyze difluoro-methyl-(3-methylsulfonylpropyl)silane with MolForge

Explore ADMET properties, 3D molecular structure, drug-likeness score, and discover similar compounds using our AI-powered platform.

Launch Full Analysis

Related Compounds

methyl 2-[difluoro(methyl)silyl]ethanesulfonate
CID 174136199
1,1,1-trifluoro-4-methylsulfonylbutane
CID 89466029
1-methylsulfonylnonane
CID 19089493
1-methylsulfonyl-3-(3-methylsulfonylpropoxy)propane
CID 91149824
5,5-difluoro-1-methylsulfonylhexane
CID 157436980
(1,1-difluoro-5-methylsulfonylpentan-2-yl)hydrazine
CID 105265023
9-methylsulfonylnonan-1-amine
CID 101417644
(1,1,1-trifluoro-5-methylsulfonylpentan-2-yl)hydrazine
CID 105215617
1-methylsulfanyl-4-methylsulfonylbutane
CID 130737042
5-methylsulfonylpent-1-yne
CID 59842148
3-[difluoro(methyl)silyl]propylsulfanyl-methylsulfanylmethanone
CID 174136105
N'-methyl-N'-(3-methylsulfonylpropyl)ethane-1,2-diamine
CID 63190884

Frequently Asked Questions

What is the IUPAC name of difluoro-methyl-(3-methylsulfonylpropyl)silane?
The IUPAC name of difluoro-methyl-(3-methylsulfonylpropyl)silane (CID 153445078) is difluoro-methyl-(3-methylsulfonylpropyl)silane.
What is the SMILES notation for difluoro-methyl-(3-methylsulfonylpropyl)silane?
The canonical SMILES for difluoro-methyl-(3-methylsulfonylpropyl)silane is C[Si](F)(F)CCCS(C)(=O)=O.
What is the InChIKey of difluoro-methyl-(3-methylsulfonylpropyl)silane?
The InChIKey is IKPIAYYCKADDHS-UHFFFAOYSA-N. The full InChI is InChI=1S/C5H12F2O2SSi/c1-10(8,9)4-3-5-11(2,6)7/h3-5H2,1-2H3.
What are the key properties of difluoro-methyl-(3-methylsulfonylpropyl)silane?
difluoro-methyl-(3-methylsulfonylpropyl)silane has a molecular weight of 202.30 g/mol, XLogP of 1.43, 4 rotatable bonds, 0 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for difluoro-methyl-(3-methylsulfonylpropyl)silane is sourced from PubChem (CID 153445078), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).