[cyclopropyl(sulfinyl)methyl]-dimethyl-phenylsilane

C12H16OSSi — CID 10466662

IUPAC[cyclopropyl(sulfinyl)methyl]-dimethyl-phenylsilane
SMILESC[Si](C)(C(=S=O)C1CC1)c1ccccc1
InChIInChI=1S/C12H16OSSi/c1-15(2,11-6-4-3-5-7-11)12(14-13)10-8-9-10/h3-7,10H,8-9H2,1-2H3
InChIKeyJODKJGWMQPQAHZ-UHFFFAOYSA-N
MW236.41 g/mol
LogP1.94
Rot. Bonds3

About [cyclopropyl(sulfinyl)methyl]-dimethyl-phenylsilane

[cyclopropyl(sulfinyl)methyl]-dimethyl-phenylsilane (PubChem CID 10466662) has the molecular formula C12H16OSSi and a molecular weight of 236.41 g/mol. Its IUPAC name is [cyclopropyl(sulfinyl)methyl]-dimethyl-phenylsilane.

Molecular Properties

Compound Name[cyclopropyl(sulfinyl)methyl]-dimethyl-phenylsilane
PubChem CID10466662
Molecular FormulaC12H16OSSi
Molecular Weight236.41 g/mol
Exact Mass236.07
IUPAC Name[cyclopropyl(sulfinyl)methyl]-dimethyl-phenylsilane
SMILESC[Si](C)(C(=S=O)C1CC1)c1ccccc1
InChIInChI=1S/C12H16OSSi/c1-15(2,11-6-4-3-5-7-11)12(14-13)10-8-9-10/h3-7,10H,8-9H2,1-2H3
InChIKeyJODKJGWMQPQAHZ-UHFFFAOYSA-N
XLogP1.94
TPSA17.07 Ų
H-Bond Donors
H-Bond Acceptors1
Rotatable Bonds3
Heavy Atoms15
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500236.41
LogP ≤ 51.94
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 101

Computed Properties (RDKit)

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

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Related Compounds

cyclopropyl-[dimethyl(phenyl)silyl]methanethione
CID 10104902
dimethyl (E)-2,3-bis[dimethyl(phenyl)silyl]but-2-enedioate
CID 101127569
cyclopentyl-methyl-diphenylsilane
CID 123376620
tetramethyl (1Z,3E)-1,4-bis[dimethyl(phenyl)silyl]buta-1,3-diene-1,2,3,4-tetracarboxylate
CID 177480244
1-[dimethyl(phenyl)silyl]butan-1-one
CID 10822186
cyclopentyl-dimethyl-phenylsilane
CID 59962320
cis-(1R,2S)-2-[dimethyl(phenyl)silyl]oxycyclopentan-1-ol
CID 10633593
1-[dimethyl(phenyl)silyl]-3-trimethylsilylpropan-1-one
CID 101379873
dimethyl-[(1S,2R)-2-methylcyclohexyl]-phenylsilane
CID 11117937
cyclopenten-1-yl-[dimethyl(phenyl)silyl]methanone
CID 71358415
(4-benzoylcyclohexyl)-phenylmethanone
CID 24722598
chloro-[10-(chloro-methyl-phenylsilyl)anthracen-9-yl]-methyl-phenylsilane
CID 139704498

Frequently Asked Questions

What is the IUPAC name of [cyclopropyl(sulfinyl)methyl]-dimethyl-phenylsilane?
The IUPAC name of [cyclopropyl(sulfinyl)methyl]-dimethyl-phenylsilane (CID 10466662) is [cyclopropyl(sulfinyl)methyl]-dimethyl-phenylsilane.
What is the SMILES notation for [cyclopropyl(sulfinyl)methyl]-dimethyl-phenylsilane?
The canonical SMILES for [cyclopropyl(sulfinyl)methyl]-dimethyl-phenylsilane is C[Si](C)(C(=S=O)C1CC1)c1ccccc1.
What is the InChIKey of [cyclopropyl(sulfinyl)methyl]-dimethyl-phenylsilane?
The InChIKey is JODKJGWMQPQAHZ-UHFFFAOYSA-N. The full InChI is InChI=1S/C12H16OSSi/c1-15(2,11-6-4-3-5-7-11)12(14-13)10-8-9-10/h3-7,10H,8-9H2,1-2H3.
What are the key properties of [cyclopropyl(sulfinyl)methyl]-dimethyl-phenylsilane?
[cyclopropyl(sulfinyl)methyl]-dimethyl-phenylsilane has a molecular weight of 236.41 g/mol, XLogP of 1.94, 3 rotatable bonds, 0 hydrogen bond donors, and 1 hydrogen bond acceptors.
Where does this data come from?
All data for [cyclopropyl(sulfinyl)methyl]-dimethyl-phenylsilane is sourced from PubChem (CID 10466662), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).