tricyclohexyl-(4-tricyclohexylstannylphenyl)stannane

C42H70Sn2 — CID 11205112

IUPACtricyclohexyl-(4-tricyclohexylstannylphenyl)stannane
SMILESc1cc([Sn](C2CCCCC2)(C2CCCCC2)C2CCCCC2)ccc1[Sn](C1CCCCC1)(C1CCCCC1)C1CCCCC1
InChIInChI=1S/6C6H11.C6H4.2Sn/c7*1-2-4-6-5-3-1;;/h6*1H,2-6H2;1-2,5-6H;;
InChIKeyHHNUAQMBBKMSJI-UHFFFAOYSA-N
MW812.44 g/mol
LogP13.00
Rot. Bonds8

About tricyclohexyl-(4-tricyclohexylstannylphenyl)stannane

tricyclohexyl-(4-tricyclohexylstannylphenyl)stannane (PubChem CID 11205112) has the molecular formula C42H70Sn2 and a molecular weight of 812.44 g/mol. Its IUPAC name is tricyclohexyl-(4-tricyclohexylstannylphenyl)stannane.

Molecular Properties

Compound Nametricyclohexyl-(4-tricyclohexylstannylphenyl)stannane
PubChem CID11205112
Molecular FormulaC42H70Sn2
Molecular Weight812.44 g/mol
Exact Mass814.35
IUPAC Nametricyclohexyl-(4-tricyclohexylstannylphenyl)stannane
SMILESc1cc([Sn](C2CCCCC2)(C2CCCCC2)C2CCCCC2)ccc1[Sn](C1CCCCC1)(C1CCCCC1)C1CCCCC1
InChIInChI=1S/6C6H11.C6H4.2Sn/c7*1-2-4-6-5-3-1;;/h6*1H,2-6H2;1-2,5-6H;;
InChIKeyHHNUAQMBBKMSJI-UHFFFAOYSA-N
XLogP13.00
TPSA0.00 Ų
H-Bond Donors
H-Bond Acceptors
Rotatable Bonds8
Heavy Atoms44
Complexity—

Lipinski Rule of Five

2 violations

RuleValue
MW ≤ 500812.44
LogP ≤ 513.00
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 100

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Frequently Asked Questions

What is the IUPAC name of tricyclohexyl-(4-tricyclohexylstannylphenyl)stannane?
The IUPAC name of tricyclohexyl-(4-tricyclohexylstannylphenyl)stannane (CID 11205112) is tricyclohexyl-(4-tricyclohexylstannylphenyl)stannane.
What is the SMILES notation for tricyclohexyl-(4-tricyclohexylstannylphenyl)stannane?
The canonical SMILES for tricyclohexyl-(4-tricyclohexylstannylphenyl)stannane is c1cc([Sn](C2CCCCC2)(C2CCCCC2)C2CCCCC2)ccc1[Sn](C1CCCCC1)(C1CCCCC1)C1CCCCC1.
What is the InChIKey of tricyclohexyl-(4-tricyclohexylstannylphenyl)stannane?
The InChIKey is HHNUAQMBBKMSJI-UHFFFAOYSA-N. The full InChI is InChI=1S/6C6H11.C6H4.2Sn/c7*1-2-4-6-5-3-1;;/h6*1H,2-6H2;1-2,5-6H;;.
What are the key properties of tricyclohexyl-(4-tricyclohexylstannylphenyl)stannane?
tricyclohexyl-(4-tricyclohexylstannylphenyl)stannane has a molecular weight of 812.44 g/mol, XLogP of 13.00, 8 rotatable bonds, 0 hydrogen bond donors, and 0 hydrogen bond acceptors.
Where does this data come from?
All data for tricyclohexyl-(4-tricyclohexylstannylphenyl)stannane is sourced from PubChem (CID 11205112), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).