(1,1-dimethyl-1-benzostannol-2-yl)-methyl-diphenylsilane

C23H24SiSn — CID 177490646

IUPAC(1,1-dimethyl-1-benzostannol-2-yl)-methyl-diphenylsilane
SMILESC[Si](C1=Cc2ccccc2[Sn]1(C)C)(c1ccccc1)c1ccccc1
InChIInChI=1S/C21H18Si.2CH3.Sn/c1-22(20-13-7-3-8-14-20,21-15-9-4-10-16-21)18-17-19-11-5-2-6-12-19;;;/h2-11,13-17H,1H3;2*1H3;
InChIKeyJBSPLKDYDQAICR-UHFFFAOYSA-N
MW447.24 g/mol
LogP3.97
Rot. Bonds3

About (1,1-dimethyl-1-benzostannol-2-yl)-methyl-diphenylsilane

(1,1-dimethyl-1-benzostannol-2-yl)-methyl-diphenylsilane (PubChem CID 177490646) has the molecular formula C23H24SiSn and a molecular weight of 447.24 g/mol. Its IUPAC name is (1,1-dimethyl-1-benzostannol-2-yl)-methyl-diphenylsilane.

Molecular Properties

Compound Name(1,1-dimethyl-1-benzostannol-2-yl)-methyl-diphenylsilane
PubChem CID177490646
Molecular FormulaC23H24SiSn
Molecular Weight447.24 g/mol
Exact Mass448.07
IUPAC Name(1,1-dimethyl-1-benzostannol-2-yl)-methyl-diphenylsilane
SMILESC[Si](C1=Cc2ccccc2[Sn]1(C)C)(c1ccccc1)c1ccccc1
InChIInChI=1S/C21H18Si.2CH3.Sn/c1-22(20-13-7-3-8-14-20,21-15-9-4-10-16-21)18-17-19-11-5-2-6-12-19;;;/h2-11,13-17H,1H3;2*1H3;
InChIKeyJBSPLKDYDQAICR-UHFFFAOYSA-N
XLogP3.97
TPSA0.00 Ų
H-Bond Donors
H-Bond Acceptors
Rotatable Bonds3
Heavy Atoms25
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500447.24
LogP ≤ 53.97
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

(1,1-dimethyl-1-benzostannol-2-yl)-trimethylsilane
CID 10471414
(1,1-diphenyl-1-benzostannol-2-yl)-trimethylsilane
CID 177494266
tetramethylsilane;trimethyl(phenyl)silane
CID 161005748
bis(bis[dimethyl(phenyl)silyl]azanide);chromium(2+)
CID 139141064
(3-chlorophenyl)-methyl-diphenylsilane
CID 101069802
[dimethyl(triphenylsilyl)silyl]-dimethyl-triphenylsilylsilane
CID 86205991
magnesium;trimethyl(phenyl)silane;dibromide
CID 175580992
trimethyl-[[4-[methyl(diphenyl)silyl]phenyl]methyl]silane
CID 139831823
tert-butyl-dimethyl-triphenylsilylsilane
CID 14143704
lithium [bromo-[methyl(diphenyl)silyl]methyl]-methyl-diphenylsilane
CID 177421733
hydroxy(triphenyl)silane
CID 139058622
2-[dimethyl(phenyl)silyl]ethyl-dimethyl-phenylsilane
CID 585640

Frequently Asked Questions

What is the IUPAC name of (1,1-dimethyl-1-benzostannol-2-yl)-methyl-diphenylsilane?
The IUPAC name of (1,1-dimethyl-1-benzostannol-2-yl)-methyl-diphenylsilane (CID 177490646) is (1,1-dimethyl-1-benzostannol-2-yl)-methyl-diphenylsilane.
What is the SMILES notation for (1,1-dimethyl-1-benzostannol-2-yl)-methyl-diphenylsilane?
The canonical SMILES for (1,1-dimethyl-1-benzostannol-2-yl)-methyl-diphenylsilane is C[Si](C1=Cc2ccccc2[Sn]1(C)C)(c1ccccc1)c1ccccc1.
What is the InChIKey of (1,1-dimethyl-1-benzostannol-2-yl)-methyl-diphenylsilane?
The InChIKey is JBSPLKDYDQAICR-UHFFFAOYSA-N. The full InChI is InChI=1S/C21H18Si.2CH3.Sn/c1-22(20-13-7-3-8-14-20,21-15-9-4-10-16-21)18-17-19-11-5-2-6-12-19;;;/h2-11,13-17H,1H3;2*1H3;.
What are the key properties of (1,1-dimethyl-1-benzostannol-2-yl)-methyl-diphenylsilane?
(1,1-dimethyl-1-benzostannol-2-yl)-methyl-diphenylsilane has a molecular weight of 447.24 g/mol, XLogP of 3.97, 3 rotatable bonds, 0 hydrogen bond donors, and 0 hydrogen bond acceptors.
Where does this data come from?
All data for (1,1-dimethyl-1-benzostannol-2-yl)-methyl-diphenylsilane is sourced from PubChem (CID 177490646), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).