3-(methoxymethoxy)prop-1-ynyl-tri(propan-2-yl)silane

C14H28O2Si — CID 11253879

IUPAC3-(methoxymethoxy)prop-1-ynyl-tri(propan-2-yl)silane
SMILESCOCOCC#C[Si](C(C)C)(C(C)C)C(C)C
InChIInChI=1S/C14H28O2Si/c1-12(2)17(13(3)4,14(5)6)10-8-9-16-11-15-7/h12-14H,9,11H2,1-7H3
InChIKeyJIRFVNMYRLCCDN-UHFFFAOYSA-N
MW256.46 g/mol
LogP3.83
Rot. Bonds6

About 3-(methoxymethoxy)prop-1-ynyl-tri(propan-2-yl)silane

3-(methoxymethoxy)prop-1-ynyl-tri(propan-2-yl)silane (PubChem CID 11253879) has the molecular formula C14H28O2Si and a molecular weight of 256.46 g/mol. Its IUPAC name is 3-(methoxymethoxy)prop-1-ynyl-tri(propan-2-yl)silane.

Molecular Properties

Compound Name3-(methoxymethoxy)prop-1-ynyl-tri(propan-2-yl)silane
PubChem CID11253879
Molecular FormulaC14H28O2Si
Molecular Weight256.46 g/mol
Exact Mass256.19
IUPAC Name3-(methoxymethoxy)prop-1-ynyl-tri(propan-2-yl)silane
SMILESCOCOCC#C[Si](C(C)C)(C(C)C)C(C)C
InChIInChI=1S/C14H28O2Si/c1-12(2)17(13(3)4,14(5)6)10-8-9-16-11-15-7/h12-14H,9,11H2,1-7H3
InChIKeyJIRFVNMYRLCCDN-UHFFFAOYSA-N
XLogP3.83
TPSA18.46 Ų
H-Bond Donors
H-Bond Acceptors2
Rotatable Bonds6
Heavy Atoms17
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500256.46
LogP ≤ 53.83
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'}, {'alert_name': 'het-C-het_not_in_ring', 'substructure': 'N/A'}, {'alert_name': 'triple_bond', 'substructure': 'N/A'}

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Frequently Asked Questions

What is the IUPAC name of 3-(methoxymethoxy)prop-1-ynyl-tri(propan-2-yl)silane?
The IUPAC name of 3-(methoxymethoxy)prop-1-ynyl-tri(propan-2-yl)silane (CID 11253879) is 3-(methoxymethoxy)prop-1-ynyl-tri(propan-2-yl)silane.
What is the SMILES notation for 3-(methoxymethoxy)prop-1-ynyl-tri(propan-2-yl)silane?
The canonical SMILES for 3-(methoxymethoxy)prop-1-ynyl-tri(propan-2-yl)silane is COCOCC#C[Si](C(C)C)(C(C)C)C(C)C.
What is the InChIKey of 3-(methoxymethoxy)prop-1-ynyl-tri(propan-2-yl)silane?
The InChIKey is JIRFVNMYRLCCDN-UHFFFAOYSA-N. The full InChI is InChI=1S/C14H28O2Si/c1-12(2)17(13(3)4,14(5)6)10-8-9-16-11-15-7/h12-14H,9,11H2,1-7H3.
What are the key properties of 3-(methoxymethoxy)prop-1-ynyl-tri(propan-2-yl)silane?
3-(methoxymethoxy)prop-1-ynyl-tri(propan-2-yl)silane has a molecular weight of 256.46 g/mol, XLogP of 3.83, 6 rotatable bonds, 0 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 3-(methoxymethoxy)prop-1-ynyl-tri(propan-2-yl)silane is sourced from PubChem (CID 11253879), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).