benzene;2-phenyloxasilinane

C16H20OSi — CID 174878349

IUPACbenzene;2-phenyloxasilinane
SMILESc1ccc([SiH]2CCCCO2)cc1.c1ccccc1
InChIInChI=1S/C10H14OSi.C6H6/c1-2-6-10(7-3-1)12-9-5-4-8-11-12;1-2-4-6-5-3-1/h1-3,6-7,12H,4-5,8-9H2;1-6H
InChIKeyYPWVOCSKDJUVJB-UHFFFAOYSA-N
MW256.42 g/mol
LogP3.11
Rot. Bonds1

About benzene;2-phenyloxasilinane

benzene;2-phenyloxasilinane (PubChem CID 174878349) has the molecular formula C16H20OSi and a molecular weight of 256.42 g/mol. Its IUPAC name is benzene;2-phenyloxasilinane.

Molecular Properties

Compound Namebenzene;2-phenyloxasilinane
PubChem CID174878349
Molecular FormulaC16H20OSi
Molecular Weight256.42 g/mol
Exact Mass256.13
IUPAC Namebenzene;2-phenyloxasilinane
SMILESc1ccc([SiH]2CCCCO2)cc1.c1ccccc1
InChIInChI=1S/C10H14OSi.C6H6/c1-2-6-10(7-3-1)12-9-5-4-8-11-12;1-2-4-6-5-3-1/h1-3,6-7,12H,4-5,8-9H2;1-6H
InChIKeyYPWVOCSKDJUVJB-UHFFFAOYSA-N
XLogP3.11
TPSA9.23 Ų
H-Bond Donors
H-Bond Acceptors1
Rotatable Bonds1
Heavy Atoms18
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500256.42
LogP ≤ 53.11
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 101

Computed Properties (RDKit)

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

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Related Compounds

2-[chloro(phenyl)methyl]oxasilinane
CID 132988306
2-(4-prop-2-enoxyphenyl)oxasilinane
CID 173182469
2-methyloxasilinane;toluene
CID 174549211
2-methyloxasilinane;phenol
CID 175061732
trimethyl-(2-phenyloxasilinan-5-yl)silane
CID 175312506
3-phenyldioxasilirane
CID 173414769
oxasilinan-2-yl(phenyl)methanesulfonic acid
CID 173345957
1,2-dichlorobenzene;dioxane
CID 174792665
trimagnesium;tris(1,2-dimethanidylbenzene);oxolane
CID 5259572
2-sulfanyloxasilinane
CID 173006045
diphenyldiazene;hydrofluoride
CID 174857584
oxolane;phenoxybenzene
CID 22620896

Frequently Asked Questions

What is the IUPAC name of benzene;2-phenyloxasilinane?
The IUPAC name of benzene;2-phenyloxasilinane (CID 174878349) is benzene;2-phenyloxasilinane.
What is the SMILES notation for benzene;2-phenyloxasilinane?
The canonical SMILES for benzene;2-phenyloxasilinane is c1ccc([SiH]2CCCCO2)cc1.c1ccccc1.
What is the InChIKey of benzene;2-phenyloxasilinane?
The InChIKey is YPWVOCSKDJUVJB-UHFFFAOYSA-N. The full InChI is InChI=1S/C10H14OSi.C6H6/c1-2-6-10(7-3-1)12-9-5-4-8-11-12;1-2-4-6-5-3-1/h1-3,6-7,12H,4-5,8-9H2;1-6H.
What are the key properties of benzene;2-phenyloxasilinane?
benzene;2-phenyloxasilinane has a molecular weight of 256.42 g/mol, XLogP of 3.11, 1 rotatable bonds, 0 hydrogen bond donors, and 1 hydrogen bond acceptors.
Where does this data come from?
All data for benzene;2-phenyloxasilinane is sourced from PubChem (CID 174878349), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).