chloro-[dimethyl-tri(propan-2-yl)silyloxysilyl]oxy-di(propan-2-yl)silane

C17H41ClO2Si3 — CID 87430693

IUPACchloro-[dimethyl-tri(propan-2-yl)silyloxysilyl]oxy-di(propan-2-yl)silane
SMILESCC(C)[Si](Cl)(O[Si](C)(C)O[Si](C(C)C)(C(C)C)C(C)C)C(C)C
InChIInChI=1S/C17H41ClO2Si3/c1-13(2)22(14(3)4,15(5)6)19-21(11,12)20-23(18,16(7)8)17(9)10/h13-17H,1-12H3
InChIKeyKVVSNKJOWLYFFH-UHFFFAOYSA-N
MW397.22 g/mol
LogP7.40
Rot. Bonds9

About chloro-[dimethyl-tri(propan-2-yl)silyloxysilyl]oxy-di(propan-2-yl)silane

chloro-[dimethyl-tri(propan-2-yl)silyloxysilyl]oxy-di(propan-2-yl)silane (PubChem CID 87430693) has the molecular formula C17H41ClO2Si3 and a molecular weight of 397.22 g/mol. Its IUPAC name is chloro-[dimethyl-tri(propan-2-yl)silyloxysilyl]oxy-di(propan-2-yl)silane.

Molecular Properties

Compound Namechloro-[dimethyl-tri(propan-2-yl)silyloxysilyl]oxy-di(propan-2-yl)silane
PubChem CID87430693
Molecular FormulaC17H41ClO2Si3
Molecular Weight397.22 g/mol
Exact Mass396.21
IUPAC Namechloro-[dimethyl-tri(propan-2-yl)silyloxysilyl]oxy-di(propan-2-yl)silane
SMILESCC(C)[Si](Cl)(O[Si](C)(C)O[Si](C(C)C)(C(C)C)C(C)C)C(C)C
InChIInChI=1S/C17H41ClO2Si3/c1-13(2)22(14(3)4,15(5)6)19-21(11,12)20-23(18,16(7)8)17(9)10/h13-17H,1-12H3
InChIKeyKVVSNKJOWLYFFH-UHFFFAOYSA-N
XLogP7.40
TPSA18.46 Ų
H-Bond Donors
H-Bond Acceptors2
Rotatable Bonds9
Heavy Atoms23
Complexity—

Lipinski Rule of Five

1 violation

RuleValue
MW ≤ 500397.22
LogP ≤ 57.40
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 102

Computed Properties (RDKit)

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

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Frequently Asked Questions

What is the IUPAC name of chloro-[dimethyl-tri(propan-2-yl)silyloxysilyl]oxy-di(propan-2-yl)silane?
The IUPAC name of chloro-[dimethyl-tri(propan-2-yl)silyloxysilyl]oxy-di(propan-2-yl)silane (CID 87430693) is chloro-[dimethyl-tri(propan-2-yl)silyloxysilyl]oxy-di(propan-2-yl)silane.
What is the SMILES notation for chloro-[dimethyl-tri(propan-2-yl)silyloxysilyl]oxy-di(propan-2-yl)silane?
The canonical SMILES for chloro-[dimethyl-tri(propan-2-yl)silyloxysilyl]oxy-di(propan-2-yl)silane is CC(C)[Si](Cl)(O[Si](C)(C)O[Si](C(C)C)(C(C)C)C(C)C)C(C)C.
What is the InChIKey of chloro-[dimethyl-tri(propan-2-yl)silyloxysilyl]oxy-di(propan-2-yl)silane?
The InChIKey is KVVSNKJOWLYFFH-UHFFFAOYSA-N. The full InChI is InChI=1S/C17H41ClO2Si3/c1-13(2)22(14(3)4,15(5)6)19-21(11,12)20-23(18,16(7)8)17(9)10/h13-17H,1-12H3.
What are the key properties of chloro-[dimethyl-tri(propan-2-yl)silyloxysilyl]oxy-di(propan-2-yl)silane?
chloro-[dimethyl-tri(propan-2-yl)silyloxysilyl]oxy-di(propan-2-yl)silane has a molecular weight of 397.22 g/mol, XLogP of 7.40, 9 rotatable bonds, 0 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for chloro-[dimethyl-tri(propan-2-yl)silyloxysilyl]oxy-di(propan-2-yl)silane is sourced from PubChem (CID 87430693), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).