tert-butyl(diphenyl)stannanylium

C16H19Sn+ — CID 18463173

IUPACtert-butyl(diphenyl)stannanylium
SMILESCC(C)(C)[Sn+](c1ccccc1)c1ccccc1
InChIInChI=1S/2C6H5.C4H9.Sn/c2*1-2-4-6-5-3-1;1-4(2)3;/h2*1-5H;1-3H3;/q;;;+1
InChIKeyKCPLKDWSSXNJCS-UHFFFAOYSA-N
MW330.04 g/mol
LogP3.10
Rot. Bonds2

About tert-butyl(diphenyl)stannanylium

tert-butyl(diphenyl)stannanylium (PubChem CID 18463173) has the molecular formula C16H19Sn+ and a molecular weight of 330.04 g/mol. Its IUPAC name is tert-butyl(diphenyl)stannanylium.

Molecular Properties

Compound Nametert-butyl(diphenyl)stannanylium
PubChem CID18463173
Molecular FormulaC16H19Sn+
Molecular Weight330.04 g/mol
Exact Mass331.05
IUPAC Nametert-butyl(diphenyl)stannanylium
SMILESCC(C)(C)[Sn+](c1ccccc1)c1ccccc1
InChIInChI=1S/2C6H5.C4H9.Sn/c2*1-2-4-6-5-3-1;1-4(2)3;/h2*1-5H;1-3H3;/q;;;+1
InChIKeyKCPLKDWSSXNJCS-UHFFFAOYSA-N
XLogP3.10
TPSA0.00 Ų
H-Bond Donors
H-Bond Acceptors
Rotatable Bonds2
Heavy Atoms17
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500330.04
LogP ≤ 53.10
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 100

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Related Compounds

dimethyl(phenyl)stannanylium hydroxide
CID 70363024
bis(2-methyl-2-phenylpropyl)-phenylstannanylium
CID 23046011
2-phenylpropan-2-ylbenzene
CID 13065
CID 171375456
CID 171375456
benzene;hexakis(2,2-dimethylpropane);ethane;naphthalene
CID 159135234
benzene;tetrakis(2,2-dimethylpropane);ethane;naphthalene
CID 163997399
(2,3,4,5-tetramethyl-4-phenylhexan-3-yl)benzene
CID 13047702
diethyl(phenyl)stannanylium fluoride
CID 21455186
azane;pentan-3-ylbenzene
CID 19774895
tert-butylbenzene;molecular nitrogen
CID 146464751
tert-butylbenzene;chloromethane;ethane
CID 91149652
benzene;tert-butylbenzene;bis(2,2-dimethylpropane);ethane
CID 158670454

Frequently Asked Questions

What is the IUPAC name of tert-butyl(diphenyl)stannanylium?
The IUPAC name of tert-butyl(diphenyl)stannanylium (CID 18463173) is tert-butyl(diphenyl)stannanylium.
What is the SMILES notation for tert-butyl(diphenyl)stannanylium?
The canonical SMILES for tert-butyl(diphenyl)stannanylium is CC(C)(C)[Sn+](c1ccccc1)c1ccccc1.
What is the InChIKey of tert-butyl(diphenyl)stannanylium?
The InChIKey is KCPLKDWSSXNJCS-UHFFFAOYSA-N. The full InChI is InChI=1S/2C6H5.C4H9.Sn/c2*1-2-4-6-5-3-1;1-4(2)3;/h2*1-5H;1-3H3;/q;;;+1.
What are the key properties of tert-butyl(diphenyl)stannanylium?
tert-butyl(diphenyl)stannanylium has a molecular weight of 330.04 g/mol, XLogP of 3.10, 2 rotatable bonds, 0 hydrogen bond donors, and 0 hydrogen bond acceptors.
Where does this data come from?
All data for tert-butyl(diphenyl)stannanylium is sourced from PubChem (CID 18463173), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).