chloro-(chloro-methyl-phenylsilyl)oxy-methyl-phenylsilane

C14H16Cl2OSi2 — CID 101051464

IUPACchloro-(chloro-methyl-phenylsilyl)oxy-methyl-phenylsilane
SMILESC[Si@](Cl)(O[Si@](C)(Cl)c1ccccc1)c1ccccc1
InChIInChI=1S/C14H16Cl2OSi2/c1-18(15,13-9-5-3-6-10-13)17-19(2,16)14-11-7-4-8-12-14/h3-12H,1-2H3/t18-,19-/m0/s1
InChIKeyAUWRUFAJYVQXSH-OALUTQOASA-N
MW327.36 g/mol
LogP3.44
Rot. Bonds4

About chloro-(chloro-methyl-phenylsilyl)oxy-methyl-phenylsilane

chloro-(chloro-methyl-phenylsilyl)oxy-methyl-phenylsilane (PubChem CID 101051464) has the molecular formula C14H16Cl2OSi2 and a molecular weight of 327.36 g/mol. Its IUPAC name is chloro-(chloro-methyl-phenylsilyl)oxy-methyl-phenylsilane.

Molecular Properties

Compound Namechloro-(chloro-methyl-phenylsilyl)oxy-methyl-phenylsilane
PubChem CID101051464
Molecular FormulaC14H16Cl2OSi2
Molecular Weight327.36 g/mol
Exact Mass326.01
IUPAC Namechloro-(chloro-methyl-phenylsilyl)oxy-methyl-phenylsilane
SMILESC[Si@](Cl)(O[Si@](C)(Cl)c1ccccc1)c1ccccc1
InChIInChI=1S/C14H16Cl2OSi2/c1-18(15,13-9-5-3-6-10-13)17-19(2,16)14-11-7-4-8-12-14/h3-12H,1-2H3/t18-,19-/m0/s1
InChIKeyAUWRUFAJYVQXSH-OALUTQOASA-N
XLogP3.44
TPSA9.23 Ų
H-Bond Donors
H-Bond Acceptors1
Rotatable Bonds4
Heavy Atoms19
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500327.36
LogP ≤ 53.44
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 101

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-(chloro-methyl-phenylsilyl)oxy-methyl-phenylsilane?
The IUPAC name of chloro-(chloro-methyl-phenylsilyl)oxy-methyl-phenylsilane (CID 101051464) is chloro-(chloro-methyl-phenylsilyl)oxy-methyl-phenylsilane.
What is the SMILES notation for chloro-(chloro-methyl-phenylsilyl)oxy-methyl-phenylsilane?
The canonical SMILES for chloro-(chloro-methyl-phenylsilyl)oxy-methyl-phenylsilane is C[Si@](Cl)(O[Si@](C)(Cl)c1ccccc1)c1ccccc1.
What is the InChIKey of chloro-(chloro-methyl-phenylsilyl)oxy-methyl-phenylsilane?
The InChIKey is AUWRUFAJYVQXSH-OALUTQOASA-N. The full InChI is InChI=1S/C14H16Cl2OSi2/c1-18(15,13-9-5-3-6-10-13)17-19(2,16)14-11-7-4-8-12-14/h3-12H,1-2H3/t18-,19-/m0/s1.
What are the key properties of chloro-(chloro-methyl-phenylsilyl)oxy-methyl-phenylsilane?
chloro-(chloro-methyl-phenylsilyl)oxy-methyl-phenylsilane has a molecular weight of 327.36 g/mol, XLogP of 3.44, 4 rotatable bonds, 0 hydrogen bond donors, and 1 hydrogen bond acceptors.
Where does this data come from?
All data for chloro-(chloro-methyl-phenylsilyl)oxy-methyl-phenylsilane is sourced from PubChem (CID 101051464), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).