hydroxy-[hydroxy-bis[(2-methylpropan-2-yl)oxy]silyl]oxy-bis[(2-methylpropan-2-yl)oxy]silane

C16H38O7Si2 — CID 12978609

IUPAChydroxy-[hydroxy-bis[(2-methylpropan-2-yl)oxy]silyl]oxy-bis[(2-methylpropan-2-yl)oxy]silane
SMILESCC(C)(C)O[Si](O)(OC(C)(C)C)O[Si](O)(OC(C)(C)C)OC(C)(C)C
InChIInChI=1S/C16H38O7Si2/c1-13(2,3)19-24(17,20-14(4,5)6)23-25(18,21-15(7,8)9)22-16(10,11)12/h17-18H,1-12H3
InChIKeyNNQOCEJDAXBGGX-UHFFFAOYSA-N
MW398.65 g/mol
LogP3.12
Rot. Bonds6

About hydroxy-[hydroxy-bis[(2-methylpropan-2-yl)oxy]silyl]oxy-bis[(2-methylpropan-2-yl)oxy]silane

hydroxy-[hydroxy-bis[(2-methylpropan-2-yl)oxy]silyl]oxy-bis[(2-methylpropan-2-yl)oxy]silane (PubChem CID 12978609) has the molecular formula C16H38O7Si2 and a molecular weight of 398.65 g/mol. Its IUPAC name is hydroxy-[hydroxy-bis[(2-methylpropan-2-yl)oxy]silyl]oxy-bis[(2-methylpropan-2-yl)oxy]silane.

Molecular Properties

Compound Namehydroxy-[hydroxy-bis[(2-methylpropan-2-yl)oxy]silyl]oxy-bis[(2-methylpropan-2-yl)oxy]silane
PubChem CID12978609
Molecular FormulaC16H38O7Si2
Molecular Weight398.65 g/mol
Exact Mass398.22
IUPAC Namehydroxy-[hydroxy-bis[(2-methylpropan-2-yl)oxy]silyl]oxy-bis[(2-methylpropan-2-yl)oxy]silane
SMILESCC(C)(C)O[Si](O)(OC(C)(C)C)O[Si](O)(OC(C)(C)C)OC(C)(C)C
InChIInChI=1S/C16H38O7Si2/c1-13(2,3)19-24(17,20-14(4,5)6)23-25(18,21-15(7,8)9)22-16(10,11)12/h17-18H,1-12H3
InChIKeyNNQOCEJDAXBGGX-UHFFFAOYSA-N
XLogP3.12
TPSA86.61 Ų
H-Bond Donors2
H-Bond Acceptors7
Rotatable Bonds6
Heavy Atoms25
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500398.65
LogP ≤ 53.12
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 107

Computed Properties (RDKit)

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

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Frequently Asked Questions

What is the IUPAC name of hydroxy-[hydroxy-bis[(2-methylpropan-2-yl)oxy]silyl]oxy-bis[(2-methylpropan-2-yl)oxy]silane?
The IUPAC name of hydroxy-[hydroxy-bis[(2-methylpropan-2-yl)oxy]silyl]oxy-bis[(2-methylpropan-2-yl)oxy]silane (CID 12978609) is hydroxy-[hydroxy-bis[(2-methylpropan-2-yl)oxy]silyl]oxy-bis[(2-methylpropan-2-yl)oxy]silane.
What is the SMILES notation for hydroxy-[hydroxy-bis[(2-methylpropan-2-yl)oxy]silyl]oxy-bis[(2-methylpropan-2-yl)oxy]silane?
The canonical SMILES for hydroxy-[hydroxy-bis[(2-methylpropan-2-yl)oxy]silyl]oxy-bis[(2-methylpropan-2-yl)oxy]silane is CC(C)(C)O[Si](O)(OC(C)(C)C)O[Si](O)(OC(C)(C)C)OC(C)(C)C.
What is the InChIKey of hydroxy-[hydroxy-bis[(2-methylpropan-2-yl)oxy]silyl]oxy-bis[(2-methylpropan-2-yl)oxy]silane?
The InChIKey is NNQOCEJDAXBGGX-UHFFFAOYSA-N. The full InChI is InChI=1S/C16H38O7Si2/c1-13(2,3)19-24(17,20-14(4,5)6)23-25(18,21-15(7,8)9)22-16(10,11)12/h17-18H,1-12H3.
What are the key properties of hydroxy-[hydroxy-bis[(2-methylpropan-2-yl)oxy]silyl]oxy-bis[(2-methylpropan-2-yl)oxy]silane?
hydroxy-[hydroxy-bis[(2-methylpropan-2-yl)oxy]silyl]oxy-bis[(2-methylpropan-2-yl)oxy]silane has a molecular weight of 398.65 g/mol, XLogP of 3.12, 6 rotatable bonds, 2 hydrogen bond donors, and 7 hydrogen bond acceptors.
Where does this data come from?
All data for hydroxy-[hydroxy-bis[(2-methylpropan-2-yl)oxy]silyl]oxy-bis[(2-methylpropan-2-yl)oxy]silane is sourced from PubChem (CID 12978609), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).