1,12-dimethyl-1,12-disilabicyclo[10.10.10]dotriacontane

C32H66Si2 — CID 177476955

IUPAC1,12-dimethyl-1,12-disilabicyclo[10.10.10]dotriacontane
SMILESC[Si]12CCCCCCCCCC[Si](C)(CCCCCCCCCC1)CCCCCCCCCC2
InChIInChI=1S/C32H66Si2/c1-33-27-21-15-9-3-6-12-18-24-30-34(2,31-25-19-13-7-4-10-16-22-28-33)32-26-20-14-8-5-11-17-23-29-33/h3-32H2,1-2H3
InChIKeySFDDQWFWEVPETR-UHFFFAOYSA-N
MW507.05 g/mol
LogP12.53
Rot. Bonds

About 1,12-dimethyl-1,12-disilabicyclo[10.10.10]dotriacontane

1,12-dimethyl-1,12-disilabicyclo[10.10.10]dotriacontane (PubChem CID 177476955) has the molecular formula C32H66Si2 and a molecular weight of 507.05 g/mol. Its IUPAC name is 1,12-dimethyl-1,12-disilabicyclo[10.10.10]dotriacontane.

Molecular Properties

Compound Name1,12-dimethyl-1,12-disilabicyclo[10.10.10]dotriacontane
PubChem CID177476955
Molecular FormulaC32H66Si2
Molecular Weight507.05 g/mol
Exact Mass506.47
IUPAC Name1,12-dimethyl-1,12-disilabicyclo[10.10.10]dotriacontane
SMILESC[Si]12CCCCCCCCCC[Si](C)(CCCCCCCCCC1)CCCCCCCCCC2
InChIInChI=1S/C32H66Si2/c1-33-27-21-15-9-3-6-12-18-24-30-34(2,31-25-19-13-7-4-10-16-22-28-33)32-26-20-14-8-5-11-17-23-29-33/h3-32H2,1-2H3
InChIKeySFDDQWFWEVPETR-UHFFFAOYSA-N
XLogP12.53
TPSA0.00 Ų
H-Bond Donors
H-Bond Acceptors
Rotatable Bonds
Heavy Atoms34
Complexity—

Lipinski Rule of Five

2 violations

RuleValue
MW ≤ 500507.05
LogP ≤ 512.53
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 100

Computed Properties (RDKit)

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

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Related Compounds

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CID 174410091
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CID 174922951
1-ethyl-1-methylsilinane;hydron
CID 174791103
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CID 14984318
cyclopropane;ethane
CID 144519947
cyclopropane;ethane
CID 167628168
cyclopropane;ethane
CID 160958790

Frequently Asked Questions

What is the IUPAC name of 1,12-dimethyl-1,12-disilabicyclo[10.10.10]dotriacontane?
The IUPAC name of 1,12-dimethyl-1,12-disilabicyclo[10.10.10]dotriacontane (CID 177476955) is 1,12-dimethyl-1,12-disilabicyclo[10.10.10]dotriacontane.
What is the SMILES notation for 1,12-dimethyl-1,12-disilabicyclo[10.10.10]dotriacontane?
The canonical SMILES for 1,12-dimethyl-1,12-disilabicyclo[10.10.10]dotriacontane is C[Si]12CCCCCCCCCC[Si](C)(CCCCCCCCCC1)CCCCCCCCCC2.
What is the InChIKey of 1,12-dimethyl-1,12-disilabicyclo[10.10.10]dotriacontane?
The InChIKey is SFDDQWFWEVPETR-UHFFFAOYSA-N. The full InChI is InChI=1S/C32H66Si2/c1-33-27-21-15-9-3-6-12-18-24-30-34(2,31-25-19-13-7-4-10-16-22-28-33)32-26-20-14-8-5-11-17-23-29-33/h3-32H2,1-2H3.
What are the key properties of 1,12-dimethyl-1,12-disilabicyclo[10.10.10]dotriacontane?
1,12-dimethyl-1,12-disilabicyclo[10.10.10]dotriacontane has a molecular weight of 507.05 g/mol, XLogP of 12.53, 0 rotatable bonds, 0 hydrogen bond donors, and 0 hydrogen bond acceptors.
Where does this data come from?
All data for 1,12-dimethyl-1,12-disilabicyclo[10.10.10]dotriacontane is sourced from PubChem (CID 177476955), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).