1,1'-biphenyl;tert-butyl(methoxy)silane

C17H24OSi — CID 161317585

IUPAC1,1'-biphenyl;tert-butyl(methoxy)silane
SMILESCO[SiH2]C(C)(C)C.c1ccc(-c2ccccc2)cc1
InChIInChI=1S/C12H10.C5H14OSi/c1-3-7-11(8-4-1)12-9-5-2-6-10-12;1-5(2,3)7-6-4/h1-10H;7H2,1-4H3
InChIKeyVJRYHBQBXHJHMM-UHFFFAOYSA-N
MW272.46 g/mol
LogP4.29
Rot. Bonds2

About 1,1'-biphenyl;tert-butyl(methoxy)silane

1,1'-biphenyl;tert-butyl(methoxy)silane (PubChem CID 161317585) has the molecular formula C17H24OSi and a molecular weight of 272.46 g/mol. Its IUPAC name is 1,1'-biphenyl;tert-butyl(methoxy)silane.

Molecular Properties

Compound Name1,1'-biphenyl;tert-butyl(methoxy)silane
PubChem CID161317585
Molecular FormulaC17H24OSi
Molecular Weight272.46 g/mol
Exact Mass272.16
IUPAC Name1,1'-biphenyl;tert-butyl(methoxy)silane
SMILESCO[SiH2]C(C)(C)C.c1ccc(-c2ccccc2)cc1
InChIInChI=1S/C12H10.C5H14OSi/c1-3-7-11(8-4-1)12-9-5-2-6-10-12;1-5(2,3)7-6-4/h1-10H;7H2,1-4H3
InChIKeyVJRYHBQBXHJHMM-UHFFFAOYSA-N
XLogP4.29
TPSA9.23 Ų
H-Bond Donors
H-Bond Acceptors1
Rotatable Bonds2
Heavy Atoms19
Complexity

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500272.46
LogP ≤ 54.29
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 101

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 1,1'-biphenyl;tert-butyl(methoxy)silane?
The IUPAC name of 1,1'-biphenyl;tert-butyl(methoxy)silane (CID 161317585) is 1,1'-biphenyl;tert-butyl(methoxy)silane.
What is the SMILES notation for 1,1'-biphenyl;tert-butyl(methoxy)silane?
The canonical SMILES for 1,1'-biphenyl;tert-butyl(methoxy)silane is CO[SiH2]C(C)(C)C.c1ccc(-c2ccccc2)cc1.
What is the InChIKey of 1,1'-biphenyl;tert-butyl(methoxy)silane?
The InChIKey is VJRYHBQBXHJHMM-UHFFFAOYSA-N. The full InChI is InChI=1S/C12H10.C5H14OSi/c1-3-7-11(8-4-1)12-9-5-2-6-10-12;1-5(2,3)7-6-4/h1-10H;7H2,1-4H3.
What are the key properties of 1,1'-biphenyl;tert-butyl(methoxy)silane?
1,1'-biphenyl;tert-butyl(methoxy)silane has a molecular weight of 272.46 g/mol, XLogP of 4.29, 2 rotatable bonds, 0 hydrogen bond donors, and 1 hydrogen bond acceptors.
Where does this data come from?
All data for 1,1'-biphenyl;tert-butyl(methoxy)silane is sourced from PubChem (CID 161317585), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).