3,3-dimethoxypropyl-[3-(3,3-dimethoxypropylsilyl)propyl]silane

C13H32O4Si2 — CID 123145212

IUPAC3,3-dimethoxypropyl-[3-(3,3-dimethoxypropylsilyl)propyl]silane
SMILESCOC(CC[SiH2]CCC[SiH2]CCC(OC)OC)OC
InChIInChI=1S/C13H32O4Si2/c1-14-12(15-2)6-10-18-8-5-9-19-11-7-13(16-3)17-4/h12-13H,5-11,18-19H2,1-4H3
InChIKeySRHXVBREKHRUFC-UHFFFAOYSA-N
MW308.57 g/mol
LogP1.41
Rot. Bonds14

About 3,3-dimethoxypropyl-[3-(3,3-dimethoxypropylsilyl)propyl]silane

3,3-dimethoxypropyl-[3-(3,3-dimethoxypropylsilyl)propyl]silane (PubChem CID 123145212) has the molecular formula C13H32O4Si2 and a molecular weight of 308.57 g/mol. Its IUPAC name is 3,3-dimethoxypropyl-[3-(3,3-dimethoxypropylsilyl)propyl]silane.

Molecular Properties

Compound Name3,3-dimethoxypropyl-[3-(3,3-dimethoxypropylsilyl)propyl]silane
PubChem CID123145212
Molecular FormulaC13H32O4Si2
Molecular Weight308.57 g/mol
Exact Mass308.18
IUPAC Name3,3-dimethoxypropyl-[3-(3,3-dimethoxypropylsilyl)propyl]silane
SMILESCOC(CC[SiH2]CCC[SiH2]CCC(OC)OC)OC
InChIInChI=1S/C13H32O4Si2/c1-14-12(15-2)6-10-18-8-5-9-19-11-7-13(16-3)17-4/h12-13H,5-11,18-19H2,1-4H3
InChIKeySRHXVBREKHRUFC-UHFFFAOYSA-N
XLogP1.41
TPSA36.92 Ų
H-Bond Donors
H-Bond Acceptors4
Rotatable Bonds14
Heavy Atoms19
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500308.57
LogP ≤ 51.41
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'}, {'alert_name': 'het-C-het_not_in_ring', 'substructure': 'N/A'}

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Frequently Asked Questions

What is the IUPAC name of 3,3-dimethoxypropyl-[3-(3,3-dimethoxypropylsilyl)propyl]silane?
The IUPAC name of 3,3-dimethoxypropyl-[3-(3,3-dimethoxypropylsilyl)propyl]silane (CID 123145212) is 3,3-dimethoxypropyl-[3-(3,3-dimethoxypropylsilyl)propyl]silane.
What is the SMILES notation for 3,3-dimethoxypropyl-[3-(3,3-dimethoxypropylsilyl)propyl]silane?
The canonical SMILES for 3,3-dimethoxypropyl-[3-(3,3-dimethoxypropylsilyl)propyl]silane is COC(CC[SiH2]CCC[SiH2]CCC(OC)OC)OC.
What is the InChIKey of 3,3-dimethoxypropyl-[3-(3,3-dimethoxypropylsilyl)propyl]silane?
The InChIKey is SRHXVBREKHRUFC-UHFFFAOYSA-N. The full InChI is InChI=1S/C13H32O4Si2/c1-14-12(15-2)6-10-18-8-5-9-19-11-7-13(16-3)17-4/h12-13H,5-11,18-19H2,1-4H3.
What are the key properties of 3,3-dimethoxypropyl-[3-(3,3-dimethoxypropylsilyl)propyl]silane?
3,3-dimethoxypropyl-[3-(3,3-dimethoxypropylsilyl)propyl]silane has a molecular weight of 308.57 g/mol, XLogP of 1.41, 14 rotatable bonds, 0 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 3,3-dimethoxypropyl-[3-(3,3-dimethoxypropylsilyl)propyl]silane is sourced from PubChem (CID 123145212), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).