2-octan-2-yloxyoxasilinane

C12H26O2Si — CID 175422829

IUPAC2-octan-2-yloxyoxasilinane
SMILESCCCCCCC(C)O[SiH]1CCCCO1
InChIInChI=1S/C12H26O2Si/c1-3-4-5-6-9-12(2)14-15-11-8-7-10-13-15/h12,15H,3-11H2,1-2H3
InChIKeyGOOWLFFWBKSJEI-UHFFFAOYSA-N
MW230.42 g/mol
LogP3.39
Rot. Bonds7

About 2-octan-2-yloxyoxasilinane

2-octan-2-yloxyoxasilinane (PubChem CID 175422829) has the molecular formula C12H26O2Si and a molecular weight of 230.42 g/mol. Its IUPAC name is 2-octan-2-yloxyoxasilinane.

Molecular Properties

Compound Name2-octan-2-yloxyoxasilinane
PubChem CID175422829
Molecular FormulaC12H26O2Si
Molecular Weight230.42 g/mol
Exact Mass230.17
IUPAC Name2-octan-2-yloxyoxasilinane
SMILESCCCCCCC(C)O[SiH]1CCCCO1
InChIInChI=1S/C12H26O2Si/c1-3-4-5-6-9-12(2)14-15-11-8-7-10-13-15/h12,15H,3-11H2,1-2H3
InChIKeyGOOWLFFWBKSJEI-UHFFFAOYSA-N
XLogP3.39
TPSA18.46 Ų
H-Bond Donors
H-Bond Acceptors2
Rotatable Bonds7
Heavy Atoms15
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500230.42
LogP ≤ 53.39
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 102

Computed Properties (RDKit)

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

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Related Compounds

2-icosan-2-yloxyoxasilinane
CID 173083357
1-octan-2-yloxydecane
CID 86220707
1-nonan-2-yloxyoctadecane
CID 88815684
2-decoxyundecane
CID 151498473
1-undecan-2-yloxypentadecane
CID 174433069
nonadecan-2-yloxy(oxan-2-yl)silane
CID 123257578
dimethyl-(2-nonadecan-2-yloxyoxan-2-yl)silane
CID 173200522
1-hexan-2-yloxydecane
CID 57029724
2-propan-2-yloxasilinane;tetradecanoic acid
CID 173217204
1,2-di(heptan-2-yloxy)cyclohexane
CID 91603551
tetradecan-2-yloxysilane
CID 173015270
O-hexadecan-2-ylhydroxylamine
CID 18799052

Frequently Asked Questions

What is the IUPAC name of 2-octan-2-yloxyoxasilinane?
The IUPAC name of 2-octan-2-yloxyoxasilinane (CID 175422829) is 2-octan-2-yloxyoxasilinane.
What is the SMILES notation for 2-octan-2-yloxyoxasilinane?
The canonical SMILES for 2-octan-2-yloxyoxasilinane is CCCCCCC(C)O[SiH]1CCCCO1.
What is the InChIKey of 2-octan-2-yloxyoxasilinane?
The InChIKey is GOOWLFFWBKSJEI-UHFFFAOYSA-N. The full InChI is InChI=1S/C12H26O2Si/c1-3-4-5-6-9-12(2)14-15-11-8-7-10-13-15/h12,15H,3-11H2,1-2H3.
What are the key properties of 2-octan-2-yloxyoxasilinane?
2-octan-2-yloxyoxasilinane has a molecular weight of 230.42 g/mol, XLogP of 3.39, 7 rotatable bonds, 0 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 2-octan-2-yloxyoxasilinane is sourced from PubChem (CID 175422829), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).