propan-2-yl(4-propylheptan-4-yloxy)silane

C13H30OSi — CID 150841022

IUPACpropan-2-yl(4-propylheptan-4-yloxy)silane
SMILESCCCC(CCC)(CCC)O[SiH2]C(C)C
InChIInChI=1S/C13H30OSi/c1-6-9-13(10-7-2,11-8-3)14-15-12(4)5/h12H,6-11,15H2,1-5H3
InChIKeyKNZJOMOBMILLJK-UHFFFAOYSA-N
MW230.47 g/mol
LogP4.05
Rot. Bonds9

About propan-2-yl(4-propylheptan-4-yloxy)silane

propan-2-yl(4-propylheptan-4-yloxy)silane (PubChem CID 150841022) has the molecular formula C13H30OSi and a molecular weight of 230.47 g/mol. Its IUPAC name is propan-2-yl(4-propylheptan-4-yloxy)silane.

Molecular Properties

Compound Namepropan-2-yl(4-propylheptan-4-yloxy)silane
PubChem CID150841022
Molecular FormulaC13H30OSi
Molecular Weight230.47 g/mol
Exact Mass230.21
IUPAC Namepropan-2-yl(4-propylheptan-4-yloxy)silane
SMILESCCCC(CCC)(CCC)O[SiH2]C(C)C
InChIInChI=1S/C13H30OSi/c1-6-9-13(10-7-2,11-8-3)14-15-12(4)5/h12H,6-11,15H2,1-5H3
InChIKeyKNZJOMOBMILLJK-UHFFFAOYSA-N
XLogP4.05
TPSA9.23 Ų
H-Bond Donors
H-Bond Acceptors1
Rotatable Bonds9
Heavy Atoms15
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500230.47
LogP ≤ 54.05
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 101

Computed Properties (RDKit)

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

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Related Compounds

3-Ethylheptan-3-yloxy(trimethyl)silane
CID 12520964
3-Ethylhexan-3-yloxy(trimethyl)silane
CID 57151756
Tert-butyl-(1-ethylcyclopentyl)oxy-dimethylsilane
CID 59761041
2,2,6-Trimethyl-6-propyloxasilinane
CID 70360490
6-Methyl-2,2,6-tripropyloxasilinane
CID 89921633
2-Methyl-2,6,6-tripropyloxasilinane
CID 89921637
Tert-butyl-dimethyl-(1-propylcyclobutyl)oxysilane
CID 90814989
3,5-Dimethylheptan-3-yloxy-ethyl-dimethylsilane
CID 91242695
3-Methylheptan-3-yloxysilane
CID 123339420
3,5-Dimethylheptan-4-yloxy(2-methylpropyl)silane
CID 123520378
3-Ethylhexan-3-yloxysilane
CID 123532591
Methyl-(1-methylcyclohexyl)oxysilane
CID 123557974

Frequently Asked Questions

What is the IUPAC name of propan-2-yl(4-propylheptan-4-yloxy)silane?
The IUPAC name of propan-2-yl(4-propylheptan-4-yloxy)silane (CID 150841022) is propan-2-yl(4-propylheptan-4-yloxy)silane.
What is the SMILES notation for propan-2-yl(4-propylheptan-4-yloxy)silane?
The canonical SMILES for propan-2-yl(4-propylheptan-4-yloxy)silane is CCCC(CCC)(CCC)O[SiH2]C(C)C.
What is the InChIKey of propan-2-yl(4-propylheptan-4-yloxy)silane?
The InChIKey is KNZJOMOBMILLJK-UHFFFAOYSA-N. The full InChI is InChI=1S/C13H30OSi/c1-6-9-13(10-7-2,11-8-3)14-15-12(4)5/h12H,6-11,15H2,1-5H3.
What are the key properties of propan-2-yl(4-propylheptan-4-yloxy)silane?
propan-2-yl(4-propylheptan-4-yloxy)silane has a molecular weight of 230.47 g/mol, XLogP of 4.05, 9 rotatable bonds, 0 hydrogen bond donors, and 1 hydrogen bond acceptors.
Where does this data come from?
All data for propan-2-yl(4-propylheptan-4-yloxy)silane is sourced from PubChem (CID 150841022), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).