{9,9-Bis[(propan-2-yl)oxy]nonyl}(methyl)silane

C16H34O2Si — CID 78066907

IUPAC—
SMILESC[Si]CCCCCCCCC(OC(C)C)OC(C)C
InChIInChI=1S/C16H34O2Si/c1-14(2)17-16(18-15(3)4)12-10-8-6-7-9-11-13-19-5/h14-16H,6-13H2,1-5H3
InChIKeyHXVVSYUUSRCQRD-UHFFFAOYSA-N
MW286.53 g/mol
LogP5.06
Rot. Bonds13

About {9,9-Bis[(propan-2-yl)oxy]nonyl}(methyl)silane

{9,9-Bis[(propan-2-yl)oxy]nonyl}(methyl)silane (PubChem CID 78066907) has the molecular formula C16H34O2Si and a molecular weight of 286.53 g/mol.

Molecular Properties

Compound Name{9,9-Bis[(propan-2-yl)oxy]nonyl}(methyl)silane
PubChem CID78066907
Molecular FormulaC16H34O2Si
Molecular Weight286.53 g/mol
Exact Mass286.23
IUPAC Name—
SMILESC[Si]CCCCCCCCC(OC(C)C)OC(C)C
InChIInChI=1S/C16H34O2Si/c1-14(2)17-16(18-15(3)4)12-10-8-6-7-9-11-13-19-5/h14-16H,6-13H2,1-5H3
InChIKeyHXVVSYUUSRCQRD-UHFFFAOYSA-N
XLogP5.06
TPSA18.46 Ų
H-Bond Donors
H-Bond Acceptors2
Rotatable Bonds13
Heavy Atoms19
Complexity—

Lipinski Rule of Five

1 violation

RuleValue
MW ≤ 500286.53
LogP ≤ 55.06
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'}

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Related Compounds

7,7-di(propan-2-yloxy)heptan-1-amine
CID 19069536
9,9-di(propan-2-yloxy)nonyl-methylsilane
CID 71406282
propan-2-yl 12,12-di(propan-2-yloxy)dodecanoate
CID 15882461
CID 22088228
CID 22088228
Hexylmethylsilane
CID 10855484
1,1,21,21-tetramethoxy-11-methylhenicosane
CID 151305042
CID 87144406
CID 87144406
bis(1-(cyclohepten-1-yl)cycloheptene);1,1-di(propan-2-yloxy)decane
CID 161454601
1-[4,4-di(propan-2-yloxy)butyl]-3-methylurea
CID 132558973
CID 87144633
CID 87144633
butane;1,1-di(propan-2-yloxy)butane;zirconium(4+)
CID 150564372
1,1-dimethoxytetradecane
CID 13265409

Frequently Asked Questions

What is the IUPAC name of {9,9-Bis[(propan-2-yl)oxy]nonyl}(methyl)silane?
The IUPAC name of {9,9-Bis[(propan-2-yl)oxy]nonyl}(methyl)silane (CID 78066907) is not available.
What is the SMILES notation for {9,9-Bis[(propan-2-yl)oxy]nonyl}(methyl)silane?
The canonical SMILES for {9,9-Bis[(propan-2-yl)oxy]nonyl}(methyl)silane is C[Si]CCCCCCCCC(OC(C)C)OC(C)C.
What is the InChIKey of {9,9-Bis[(propan-2-yl)oxy]nonyl}(methyl)silane?
The InChIKey is HXVVSYUUSRCQRD-UHFFFAOYSA-N. The full InChI is InChI=1S/C16H34O2Si/c1-14(2)17-16(18-15(3)4)12-10-8-6-7-9-11-13-19-5/h14-16H,6-13H2,1-5H3.
What are the key properties of {9,9-Bis[(propan-2-yl)oxy]nonyl}(methyl)silane?
{9,9-Bis[(propan-2-yl)oxy]nonyl}(methyl)silane has a molecular weight of 286.53 g/mol, XLogP of 5.06, 13 rotatable bonds, 0 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for {9,9-Bis[(propan-2-yl)oxy]nonyl}(methyl)silane is sourced from PubChem (CID 78066907), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).