trimethyl-[4-[2-(4-trimethylstannylphenyl)propan-2-yl]phenyl]stannane

C21H32Sn2 — CID 177409961

IUPACtrimethyl-[4-[2-(4-trimethylstannylphenyl)propan-2-yl]phenyl]stannane
SMILESCC(C)(c1ccc([Sn](C)(C)C)cc1)c1ccc([Sn](C)(C)C)cc1
InChIInChI=1S/C15H14.6CH3.2Sn/c1-15(2,13-9-5-3-6-10-13)14-11-7-4-8-12-14;;;;;;;;/h5-12H,1-2H3;6*1H3;;
InChIKeyBYYURKZWFGBSSQ-UHFFFAOYSA-N
MW521.91 g/mol
LogP5.10
Rot. Bonds4

About trimethyl-[4-[2-(4-trimethylstannylphenyl)propan-2-yl]phenyl]stannane

trimethyl-[4-[2-(4-trimethylstannylphenyl)propan-2-yl]phenyl]stannane (PubChem CID 177409961) has the molecular formula C21H32Sn2 and a molecular weight of 521.91 g/mol. Its IUPAC name is trimethyl-[4-[2-(4-trimethylstannylphenyl)propan-2-yl]phenyl]stannane.

Molecular Properties

Compound Nametrimethyl-[4-[2-(4-trimethylstannylphenyl)propan-2-yl]phenyl]stannane
PubChem CID177409961
Molecular FormulaC21H32Sn2
Molecular Weight521.91 g/mol
Exact Mass524.05
IUPAC Nametrimethyl-[4-[2-(4-trimethylstannylphenyl)propan-2-yl]phenyl]stannane
SMILESCC(C)(c1ccc([Sn](C)(C)C)cc1)c1ccc([Sn](C)(C)C)cc1
InChIInChI=1S/C15H14.6CH3.2Sn/c1-15(2,13-9-5-3-6-10-13)14-11-7-4-8-12-14;;;;;;;;/h5-12H,1-2H3;6*1H3;;
InChIKeyBYYURKZWFGBSSQ-UHFFFAOYSA-N
XLogP5.10
TPSA0.00 Ų
H-Bond Donors
H-Bond Acceptors
Rotatable Bonds4
Heavy Atoms23
Complexity—

Lipinski Rule of Five

2 violations

RuleValue
MW ≤ 500521.91
LogP ≤ 55.10
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 100

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Frequently Asked Questions

What is the IUPAC name of trimethyl-[4-[2-(4-trimethylstannylphenyl)propan-2-yl]phenyl]stannane?
The IUPAC name of trimethyl-[4-[2-(4-trimethylstannylphenyl)propan-2-yl]phenyl]stannane (CID 177409961) is trimethyl-[4-[2-(4-trimethylstannylphenyl)propan-2-yl]phenyl]stannane.
What is the SMILES notation for trimethyl-[4-[2-(4-trimethylstannylphenyl)propan-2-yl]phenyl]stannane?
The canonical SMILES for trimethyl-[4-[2-(4-trimethylstannylphenyl)propan-2-yl]phenyl]stannane is CC(C)(c1ccc([Sn](C)(C)C)cc1)c1ccc([Sn](C)(C)C)cc1.
What is the InChIKey of trimethyl-[4-[2-(4-trimethylstannylphenyl)propan-2-yl]phenyl]stannane?
The InChIKey is BYYURKZWFGBSSQ-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H14.6CH3.2Sn/c1-15(2,13-9-5-3-6-10-13)14-11-7-4-8-12-14;;;;;;;;/h5-12H,1-2H3;6*1H3;;.
What are the key properties of trimethyl-[4-[2-(4-trimethylstannylphenyl)propan-2-yl]phenyl]stannane?
trimethyl-[4-[2-(4-trimethylstannylphenyl)propan-2-yl]phenyl]stannane has a molecular weight of 521.91 g/mol, XLogP of 5.10, 4 rotatable bonds, 0 hydrogen bond donors, and 0 hydrogen bond acceptors.
Where does this data come from?
All data for trimethyl-[4-[2-(4-trimethylstannylphenyl)propan-2-yl]phenyl]stannane is sourced from PubChem (CID 177409961), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).