2-[chloro(phenyl)methyl]oxasilinane

C11H15ClOSi — CID 132988306

IUPAC2-[chloro(phenyl)methyl]oxasilinane
SMILESClC(c1ccccc1)[SiH]1CCCCO1
InChIInChI=1S/C11H15ClOSi/c12-11(10-6-2-1-3-7-10)14-9-5-4-8-13-14/h1-3,6-7,11,14H,4-5,8-9H2
InChIKeySGEUCIQUEIQPJD-UHFFFAOYSA-N
MW226.78 g/mol
LogP3.04
Rot. Bonds2

About 2-[chloro(phenyl)methyl]oxasilinane

2-[chloro(phenyl)methyl]oxasilinane (PubChem CID 132988306) has the molecular formula C11H15ClOSi and a molecular weight of 226.78 g/mol. Its IUPAC name is 2-[chloro(phenyl)methyl]oxasilinane.

Molecular Properties

Compound Name2-[chloro(phenyl)methyl]oxasilinane
PubChem CID132988306
Molecular FormulaC11H15ClOSi
Molecular Weight226.78 g/mol
Exact Mass226.06
IUPAC Name2-[chloro(phenyl)methyl]oxasilinane
SMILESClC(c1ccccc1)[SiH]1CCCCO1
InChIInChI=1S/C11H15ClOSi/c12-11(10-6-2-1-3-7-10)14-9-5-4-8-13-14/h1-3,6-7,11,14H,4-5,8-9H2
InChIKeySGEUCIQUEIQPJD-UHFFFAOYSA-N
XLogP3.04
TPSA9.23 Ų
H-Bond Donors
H-Bond Acceptors1
Rotatable Bonds2
Heavy Atoms14
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500226.78
LogP ≤ 53.04
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 101

Computed Properties (RDKit)

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

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Related Compounds

oxasilinan-2-yl(phenyl)methanesulfonic acid
CID 173345957
benzene;2-phenyloxasilinane
CID 174878349
2-methyloxasilinane;toluene
CID 174549211
2-methyloxasilinane;phenol
CID 175061732
[(1R)-1-chloroethyl]benzene
CID 642190
2-chloro-1-(oxan-2-yl)-2-phenylethanone
CID 81236728
dichloromethylbenzene
CID 7411
1-(oxasilinan-2-yl)ethane-1,2-diol
CID 173483101
2-[chloro(phenyl)methyl]oxolane
CID 11084790
[chloro(phenyl)methyl]benzene;sulfane
CID 139508334
(Chlorobenzyl)silane
CID 23051080
2-(3,4,4-trifluorobutan-2-yl)oxasilinane
CID 173009517

Frequently Asked Questions

What is the IUPAC name of 2-[chloro(phenyl)methyl]oxasilinane?
The IUPAC name of 2-[chloro(phenyl)methyl]oxasilinane (CID 132988306) is 2-[chloro(phenyl)methyl]oxasilinane.
What is the SMILES notation for 2-[chloro(phenyl)methyl]oxasilinane?
The canonical SMILES for 2-[chloro(phenyl)methyl]oxasilinane is ClC(c1ccccc1)[SiH]1CCCCO1.
What is the InChIKey of 2-[chloro(phenyl)methyl]oxasilinane?
The InChIKey is SGEUCIQUEIQPJD-UHFFFAOYSA-N. The full InChI is InChI=1S/C11H15ClOSi/c12-11(10-6-2-1-3-7-10)14-9-5-4-8-13-14/h1-3,6-7,11,14H,4-5,8-9H2.
What are the key properties of 2-[chloro(phenyl)methyl]oxasilinane?
2-[chloro(phenyl)methyl]oxasilinane has a molecular weight of 226.78 g/mol, XLogP of 3.04, 2 rotatable bonds, 0 hydrogen bond donors, and 1 hydrogen bond acceptors.
Where does this data come from?
All data for 2-[chloro(phenyl)methyl]oxasilinane is sourced from PubChem (CID 132988306), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).