propan-2-yl-[4-[propan-2-yl(dipropoxy)silyl]butyl]-dipropoxysilane

C22H50O4Si2 — CID 87143863

IUPACpropan-2-yl-[4-[propan-2-yl(dipropoxy)silyl]butyl]-dipropoxysilane
SMILESCCCO[Si](CCCC[Si](OCCC)(OCCC)C(C)C)(OCCC)C(C)C
InChIInChI=1S/C22H50O4Si2/c1-9-15-23-27(21(5)6,24-16-10-2)19-13-14-20-28(22(7)8,25-17-11-3)26-18-12-4/h21-22H,9-20H2,1-8H3
InChIKeyISTWIRGHJHKNMH-UHFFFAOYSA-N
MW434.81 g/mol
LogP7.18
Rot. Bonds19

About propan-2-yl-[4-[propan-2-yl(dipropoxy)silyl]butyl]-dipropoxysilane

propan-2-yl-[4-[propan-2-yl(dipropoxy)silyl]butyl]-dipropoxysilane (PubChem CID 87143863) has the molecular formula C22H50O4Si2 and a molecular weight of 434.81 g/mol. Its IUPAC name is propan-2-yl-[4-[propan-2-yl(dipropoxy)silyl]butyl]-dipropoxysilane.

Molecular Properties

Compound Namepropan-2-yl-[4-[propan-2-yl(dipropoxy)silyl]butyl]-dipropoxysilane
PubChem CID87143863
Molecular FormulaC22H50O4Si2
Molecular Weight434.81 g/mol
Exact Mass434.32
IUPAC Namepropan-2-yl-[4-[propan-2-yl(dipropoxy)silyl]butyl]-dipropoxysilane
SMILESCCCO[Si](CCCC[Si](OCCC)(OCCC)C(C)C)(OCCC)C(C)C
InChIInChI=1S/C22H50O4Si2/c1-9-15-23-27(21(5)6,24-16-10-2)19-13-14-20-28(22(7)8,25-17-11-3)26-18-12-4/h21-22H,9-20H2,1-8H3
InChIKeyISTWIRGHJHKNMH-UHFFFAOYSA-N
XLogP7.18
TPSA36.92 Ų
H-Bond Donors
H-Bond Acceptors4
Rotatable Bonds19
Heavy Atoms28
Complexity—

Lipinski Rule of Five

1 violation

RuleValue
MW ≤ 500434.81
LogP ≤ 57.18
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 104

Computed Properties (RDKit)

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

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Related Compounds

dibutoxy-[4-[dibutoxy(propan-2-yl)silyl]butyl]-propan-2-ylsilane
CID 87144336
4-[butyl(dipropoxy)silyl]pentan-1-amine
CID 88812128
methyl-[2-[methyl-di(propan-2-yloxy)silyl]ethyl]-dipropoxysilane
CID 59537880
trihexadecyl(propoxy)silane
CID 172579393
hexadecyl(tripropoxy)silane
CID 22228651
icosyl(tripropoxy)silane
CID 141079291
4-tripropoxysilylbutan-1-amine
CID 15986561
hexadecyl-methyl-dipropoxysilane
CID 22228671
3-[dimethoxy(pentyl)silyl]butan-2-yl-dimethoxy-pentylsilane
CID 141219255
decyl-methyl-dipropoxysilane
CID 22228658
tert-butyl-[4-[tert-butyl(dipropoxy)silyl]butyl]-dipropoxysilane
CID 87144385
N-[propan-2-yl(dipropoxy)silyl]butan-1-amine
CID 87635324

Frequently Asked Questions

What is the IUPAC name of propan-2-yl-[4-[propan-2-yl(dipropoxy)silyl]butyl]-dipropoxysilane?
The IUPAC name of propan-2-yl-[4-[propan-2-yl(dipropoxy)silyl]butyl]-dipropoxysilane (CID 87143863) is propan-2-yl-[4-[propan-2-yl(dipropoxy)silyl]butyl]-dipropoxysilane.
What is the SMILES notation for propan-2-yl-[4-[propan-2-yl(dipropoxy)silyl]butyl]-dipropoxysilane?
The canonical SMILES for propan-2-yl-[4-[propan-2-yl(dipropoxy)silyl]butyl]-dipropoxysilane is CCCO[Si](CCCC[Si](OCCC)(OCCC)C(C)C)(OCCC)C(C)C.
What is the InChIKey of propan-2-yl-[4-[propan-2-yl(dipropoxy)silyl]butyl]-dipropoxysilane?
The InChIKey is ISTWIRGHJHKNMH-UHFFFAOYSA-N. The full InChI is InChI=1S/C22H50O4Si2/c1-9-15-23-27(21(5)6,24-16-10-2)19-13-14-20-28(22(7)8,25-17-11-3)26-18-12-4/h21-22H,9-20H2,1-8H3.
What are the key properties of propan-2-yl-[4-[propan-2-yl(dipropoxy)silyl]butyl]-dipropoxysilane?
propan-2-yl-[4-[propan-2-yl(dipropoxy)silyl]butyl]-dipropoxysilane has a molecular weight of 434.81 g/mol, XLogP of 7.18, 19 rotatable bonds, 0 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for propan-2-yl-[4-[propan-2-yl(dipropoxy)silyl]butyl]-dipropoxysilane is sourced from PubChem (CID 87143863), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).