5-(oxiran-2-ylmethoxy)pentan-2-yloxy-di(propan-2-yl)silane

C14H30O3Si — CID 173147325

IUPAC5-(oxiran-2-ylmethoxy)pentan-2-yloxy-di(propan-2-yl)silane
SMILESCC(CCCOCC1CO1)O[SiH](C(C)C)C(C)C
InChIInChI=1S/C14H30O3Si/c1-11(2)18(12(3)4)17-13(5)7-6-8-15-9-14-10-16-14/h11-14,18H,6-10H2,1-5H3
InChIKeyPRBVOWKSKYTCRQ-UHFFFAOYSA-N
MW274.48 g/mol
LogP3.13
Rot. Bonds10

About 5-(oxiran-2-ylmethoxy)pentan-2-yloxy-di(propan-2-yl)silane

5-(oxiran-2-ylmethoxy)pentan-2-yloxy-di(propan-2-yl)silane (PubChem CID 173147325) has the molecular formula C14H30O3Si and a molecular weight of 274.48 g/mol. Its IUPAC name is 5-(oxiran-2-ylmethoxy)pentan-2-yloxy-di(propan-2-yl)silane.

Molecular Properties

Compound Name5-(oxiran-2-ylmethoxy)pentan-2-yloxy-di(propan-2-yl)silane
PubChem CID173147325
Molecular FormulaC14H30O3Si
Molecular Weight274.48 g/mol
Exact Mass274.20
IUPAC Name5-(oxiran-2-ylmethoxy)pentan-2-yloxy-di(propan-2-yl)silane
SMILESCC(CCCOCC1CO1)O[SiH](C(C)C)C(C)C
InChIInChI=1S/C14H30O3Si/c1-11(2)18(12(3)4)17-13(5)7-6-8-15-9-14-10-16-14/h11-14,18H,6-10H2,1-5H3
InChIKeyPRBVOWKSKYTCRQ-UHFFFAOYSA-N
XLogP3.13
TPSA30.99 Ų
H-Bond Donors
H-Bond Acceptors3
Rotatable Bonds10
Heavy Atoms18
Complexity

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500274.48
LogP ≤ 53.13
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 103

Computed Properties (RDKit)

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

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Frequently Asked Questions

What is the IUPAC name of 5-(oxiran-2-ylmethoxy)pentan-2-yloxy-di(propan-2-yl)silane?
The IUPAC name of 5-(oxiran-2-ylmethoxy)pentan-2-yloxy-di(propan-2-yl)silane (CID 173147325) is 5-(oxiran-2-ylmethoxy)pentan-2-yloxy-di(propan-2-yl)silane.
What is the SMILES notation for 5-(oxiran-2-ylmethoxy)pentan-2-yloxy-di(propan-2-yl)silane?
The canonical SMILES for 5-(oxiran-2-ylmethoxy)pentan-2-yloxy-di(propan-2-yl)silane is CC(CCCOCC1CO1)O[SiH](C(C)C)C(C)C.
What is the InChIKey of 5-(oxiran-2-ylmethoxy)pentan-2-yloxy-di(propan-2-yl)silane?
The InChIKey is PRBVOWKSKYTCRQ-UHFFFAOYSA-N. The full InChI is InChI=1S/C14H30O3Si/c1-11(2)18(12(3)4)17-13(5)7-6-8-15-9-14-10-16-14/h11-14,18H,6-10H2,1-5H3.
What are the key properties of 5-(oxiran-2-ylmethoxy)pentan-2-yloxy-di(propan-2-yl)silane?
5-(oxiran-2-ylmethoxy)pentan-2-yloxy-di(propan-2-yl)silane has a molecular weight of 274.48 g/mol, XLogP of 3.13, 10 rotatable bonds, 0 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 5-(oxiran-2-ylmethoxy)pentan-2-yloxy-di(propan-2-yl)silane is sourced from PubChem (CID 173147325), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).