4-(oxiran-2-ylmethoxy)hexylsilane

C9H20O2Si — CID 174850618

IUPAC4-(oxiran-2-ylmethoxy)hexylsilane
SMILESCCC(CCC[SiH3])OCC1CO1
InChIInChI=1S/C9H20O2Si/c1-2-8(4-3-5-12)10-6-9-7-11-9/h8-9H,2-7H2,1,12H3
InChIKeyXAOANOFRBKMHSY-UHFFFAOYSA-N
MW188.34 g/mol
LogP0.74
Rot. Bonds7

About 4-(oxiran-2-ylmethoxy)hexylsilane

4-(oxiran-2-ylmethoxy)hexylsilane (PubChem CID 174850618) has the molecular formula C9H20O2Si and a molecular weight of 188.34 g/mol. Its IUPAC name is 4-(oxiran-2-ylmethoxy)hexylsilane.

Molecular Properties

Compound Name4-(oxiran-2-ylmethoxy)hexylsilane
PubChem CID174850618
Molecular FormulaC9H20O2Si
Molecular Weight188.34 g/mol
Exact Mass188.12
IUPAC Name4-(oxiran-2-ylmethoxy)hexylsilane
SMILESCCC(CCC[SiH3])OCC1CO1
InChIInChI=1S/C9H20O2Si/c1-2-8(4-3-5-12)10-6-9-7-11-9/h8-9H,2-7H2,1,12H3
InChIKeyXAOANOFRBKMHSY-UHFFFAOYSA-N
XLogP0.74
TPSA21.76 Ų
H-Bond Donors
H-Bond Acceptors2
Rotatable Bonds7
Heavy Atoms12
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500188.34
LogP ≤ 50.74
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 102

Computed Properties (RDKit)

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

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Related Compounds

2-(icosan-9-yloxymethyl)oxirane
CID 19926010
2-(1-chlorobutan-2-yloxymethyl)oxirane
CID 58763744
2-(tetradecan-4-yloxymethyl)oxirane
CID 172858851
2-[1-(oxiran-2-ylmethoxy)hexan-2-yloxymethyl]oxirane
CID 71413330
trimethoxy-[6-(oxiran-2-ylmethoxy)oct-1-enyl]silane
CID 174679686
2-[1-[4-[2-(oxiran-2-ylmethoxy)butyl]phenyl]butan-2-yloxymethyl]oxirane
CID 174820293
CID 156703018
CID 156703018
CID 18963638
CID 18963638
2-[7-(oxiran-2-ylmethoxy)octan-2-yloxymethyl]oxirane
CID 101275367
2-[(7-ethyl-5,5,7-trimethylnonan-3-yl)oxymethyl]oxirane
CID 89079349
2-[2-[2-[2-[2-[2-[2-[2-[2-[2-(oxiran-2-ylmethoxy)hexoxy]ethoxy]ethoxy]ethoxy]ethoxy]ethoxy]ethoxy]ethoxy]ethoxy]ethanol
CID 59991511
2-(1-bromoethoxymethyl)oxirane
CID 20568723

Frequently Asked Questions

What is the IUPAC name of 4-(oxiran-2-ylmethoxy)hexylsilane?
The IUPAC name of 4-(oxiran-2-ylmethoxy)hexylsilane (CID 174850618) is 4-(oxiran-2-ylmethoxy)hexylsilane.
What is the SMILES notation for 4-(oxiran-2-ylmethoxy)hexylsilane?
The canonical SMILES for 4-(oxiran-2-ylmethoxy)hexylsilane is CCC(CCC[SiH3])OCC1CO1.
What is the InChIKey of 4-(oxiran-2-ylmethoxy)hexylsilane?
The InChIKey is XAOANOFRBKMHSY-UHFFFAOYSA-N. The full InChI is InChI=1S/C9H20O2Si/c1-2-8(4-3-5-12)10-6-9-7-11-9/h8-9H,2-7H2,1,12H3.
What are the key properties of 4-(oxiran-2-ylmethoxy)hexylsilane?
4-(oxiran-2-ylmethoxy)hexylsilane has a molecular weight of 188.34 g/mol, XLogP of 0.74, 7 rotatable bonds, 0 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 4-(oxiran-2-ylmethoxy)hexylsilane is sourced from PubChem (CID 174850618), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).