benzyl-[2-(2-methylsilyloxan-2-yl)oxan-2-yl]silane

C18H30O2Si2 — CID 173234932

IUPACbenzyl-[2-(2-methylsilyloxan-2-yl)oxan-2-yl]silane
SMILESC[SiH2]C1(C2([SiH2]Cc3ccccc3)CCCCO2)CCCCO1
InChIInChI=1S/C18H30O2Si2/c1-21-17(11-5-7-13-19-17)18(12-6-8-14-20-18)22-15-16-9-3-2-4-10-16/h2-4,9-10H,5-8,11-15,21-22H2,1H3
InChIKeyVKUAFRXDHRTDRQ-UHFFFAOYSA-N
MW334.61 g/mol
LogP2.37
Rot. Bonds5

About benzyl-[2-(2-methylsilyloxan-2-yl)oxan-2-yl]silane

benzyl-[2-(2-methylsilyloxan-2-yl)oxan-2-yl]silane (PubChem CID 173234932) has the molecular formula C18H30O2Si2 and a molecular weight of 334.61 g/mol. Its IUPAC name is benzyl-[2-(2-methylsilyloxan-2-yl)oxan-2-yl]silane.

Molecular Properties

Compound Namebenzyl-[2-(2-methylsilyloxan-2-yl)oxan-2-yl]silane
PubChem CID173234932
Molecular FormulaC18H30O2Si2
Molecular Weight334.61 g/mol
Exact Mass334.18
IUPAC Namebenzyl-[2-(2-methylsilyloxan-2-yl)oxan-2-yl]silane
SMILESC[SiH2]C1(C2([SiH2]Cc3ccccc3)CCCCO2)CCCCO1
InChIInChI=1S/C18H30O2Si2/c1-21-17(11-5-7-13-19-17)18(12-6-8-14-20-18)22-15-16-9-3-2-4-10-16/h2-4,9-10H,5-8,11-15,21-22H2,1H3
InChIKeyVKUAFRXDHRTDRQ-UHFFFAOYSA-N
XLogP2.37
TPSA18.46 Ų
H-Bond Donors
H-Bond Acceptors2
Rotatable Bonds5
Heavy Atoms22
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500334.61
LogP ≤ 52.37
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 102

Computed Properties (RDKit)

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

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Related Compounds

N-methyl-1-(2-methyloxan-2-yl)-2-phenylethanamine
CID 80685072
2,2-bis(phenylsulfanyl)oxane
CID 14100930
N-methyl-1-(2-methyloxan-2-yl)-3-phenylpropan-1-amine
CID 80684297
benzyl-[2-[1-(2-bicyclo[2.2.1]hept-1-enyl)ethyl]oxan-2-yl]silane
CID 174992610
(2-benzyloxan-2-yl)silane
CID 123186626
methyl-[2-(2-phenylpropyl)oxan-2-yl]silane
CID 174818120
1-(2-methyloxan-2-yl)-3-phenyl-N-propylpropan-1-amine
CID 80684951
hydron;[2-[2-phenyl-1-(2-silyloxan-2-yl)ethyl]oxan-2-yl]silane
CID 174558999
2-benzyloxane-2-carbonitrile
CID 12030268
2-benzyloxane-2-carboxylic acid
CID 12030266
[2-(3-chloro-2-phenylpropyl)oxan-2-yl]-methylsilane
CID 174991551
1,4-dioxaspiro[4.5]decane;phenylmethanamine
CID 143618966

Frequently Asked Questions

What is the IUPAC name of benzyl-[2-(2-methylsilyloxan-2-yl)oxan-2-yl]silane?
The IUPAC name of benzyl-[2-(2-methylsilyloxan-2-yl)oxan-2-yl]silane (CID 173234932) is benzyl-[2-(2-methylsilyloxan-2-yl)oxan-2-yl]silane.
What is the SMILES notation for benzyl-[2-(2-methylsilyloxan-2-yl)oxan-2-yl]silane?
The canonical SMILES for benzyl-[2-(2-methylsilyloxan-2-yl)oxan-2-yl]silane is C[SiH2]C1(C2([SiH2]Cc3ccccc3)CCCCO2)CCCCO1.
What is the InChIKey of benzyl-[2-(2-methylsilyloxan-2-yl)oxan-2-yl]silane?
The InChIKey is VKUAFRXDHRTDRQ-UHFFFAOYSA-N. The full InChI is InChI=1S/C18H30O2Si2/c1-21-17(11-5-7-13-19-17)18(12-6-8-14-20-18)22-15-16-9-3-2-4-10-16/h2-4,9-10H,5-8,11-15,21-22H2,1H3.
What are the key properties of benzyl-[2-(2-methylsilyloxan-2-yl)oxan-2-yl]silane?
benzyl-[2-(2-methylsilyloxan-2-yl)oxan-2-yl]silane has a molecular weight of 334.61 g/mol, XLogP of 2.37, 5 rotatable bonds, 0 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for benzyl-[2-(2-methylsilyloxan-2-yl)oxan-2-yl]silane is sourced from PubChem (CID 173234932), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).