oxan-2-yl(phenyl)silane

C11H16OSi — CID 123640757

IUPACoxan-2-yl(phenyl)silane
SMILESc1ccc([SiH2]C2CCCCO2)cc1
InChIInChI=1S/C11H16OSi/c1-2-6-10(7-3-1)13-11-8-4-5-9-12-11/h1-3,6-7,11H,4-5,8-9,13H2
InChIKeyYNAHTRGVXWMQMB-UHFFFAOYSA-N
MW192.33 g/mol
LogP1.01
Rot. Bonds2

About oxan-2-yl(phenyl)silane

oxan-2-yl(phenyl)silane (PubChem CID 123640757) has the molecular formula C11H16OSi and a molecular weight of 192.33 g/mol. Its IUPAC name is oxan-2-yl(phenyl)silane.

Molecular Properties

Compound Nameoxan-2-yl(phenyl)silane
PubChem CID123640757
Molecular FormulaC11H16OSi
Molecular Weight192.33 g/mol
Exact Mass192.10
IUPAC Nameoxan-2-yl(phenyl)silane
SMILESc1ccc([SiH2]C2CCCCO2)cc1
InChIInChI=1S/C11H16OSi/c1-2-6-10(7-3-1)13-11-8-4-5-9-12-11/h1-3,6-7,11H,4-5,8-9,13H2
InChIKeyYNAHTRGVXWMQMB-UHFFFAOYSA-N
XLogP1.01
TPSA9.23 Ų
H-Bond Donors
H-Bond Acceptors1
Rotatable Bonds2
Heavy Atoms13
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500192.33
LogP ≤ 51.01
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

benzyl(oxan-2-yl)silane
CID 123526004
CID 123578263
CID 123578263
benzene;methyl(oxan-2-yl)silane
CID 174962664
oxan-2-yl(4-phenylbutyl)silane
CID 173014298
oxan-2-yl(1-phenylpentan-2-yl)silane
CID 173081918
2-phenylselanyloxane
CID 11118188
2-[(2R)-oxan-2-yl]phenol
CID 92978074
oxan-2-ylsilylformic acid
CID 123628710
2-[(2-fluorophenyl)methyl]oxane
CID 20724373
2-benzyloxepane
CID 14272917
2-phenyl-1,3-dioxonane
CID 70602118
2-(phenylsulfanylmethylsulfanyl)oxane
CID 15251861

Frequently Asked Questions

What is the IUPAC name of oxan-2-yl(phenyl)silane?
The IUPAC name of oxan-2-yl(phenyl)silane (CID 123640757) is oxan-2-yl(phenyl)silane.
What is the SMILES notation for oxan-2-yl(phenyl)silane?
The canonical SMILES for oxan-2-yl(phenyl)silane is c1ccc([SiH2]C2CCCCO2)cc1.
What is the InChIKey of oxan-2-yl(phenyl)silane?
The InChIKey is YNAHTRGVXWMQMB-UHFFFAOYSA-N. The full InChI is InChI=1S/C11H16OSi/c1-2-6-10(7-3-1)13-11-8-4-5-9-12-11/h1-3,6-7,11H,4-5,8-9,13H2.
What are the key properties of oxan-2-yl(phenyl)silane?
oxan-2-yl(phenyl)silane has a molecular weight of 192.33 g/mol, XLogP of 1.01, 2 rotatable bonds, 0 hydrogen bond donors, and 1 hydrogen bond acceptors.
Where does this data come from?
All data for oxan-2-yl(phenyl)silane is sourced from PubChem (CID 123640757), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).