bis[(2-ethyl-1-phenylinden-1-yl)methyl]silane

C36H36Si — CID 137328470

IUPACbis[(2-ethyl-1-phenylinden-1-yl)methyl]silane
SMILESCCC1=Cc2ccccc2C1(C[SiH2]CC1(c2ccccc2)C(CC)=Cc2ccccc21)c1ccccc1
InChIInChI=1S/C36H36Si/c1-3-29-23-27-15-11-13-21-33(27)35(29,31-17-7-5-8-18-31)25-37-26-36(32-19-9-6-10-20-32)30(4-2)24-28-16-12-14-22-34(28)36/h5-24H,3-4,25-26,37H2,1-2H3
InChIKeyCQYFBBSSNAPAMF-UHFFFAOYSA-N
MW496.77 g/mol
LogP8.58
Rot. Bonds8

About bis[(2-ethyl-1-phenylinden-1-yl)methyl]silane

bis[(2-ethyl-1-phenylinden-1-yl)methyl]silane (PubChem CID 137328470) has the molecular formula C36H36Si and a molecular weight of 496.77 g/mol. Its IUPAC name is bis[(2-ethyl-1-phenylinden-1-yl)methyl]silane.

Molecular Properties

Compound Namebis[(2-ethyl-1-phenylinden-1-yl)methyl]silane
PubChem CID137328470
Molecular FormulaC36H36Si
Molecular Weight496.77 g/mol
Exact Mass496.26
IUPAC Namebis[(2-ethyl-1-phenylinden-1-yl)methyl]silane
SMILESCCC1=Cc2ccccc2C1(C[SiH2]CC1(c2ccccc2)C(CC)=Cc2ccccc21)c1ccccc1
InChIInChI=1S/C36H36Si/c1-3-29-23-27-15-11-13-21-33(27)35(29,31-17-7-5-8-18-31)25-37-26-36(32-19-9-6-10-20-32)30(4-2)24-28-16-12-14-22-34(28)36/h5-24H,3-4,25-26,37H2,1-2H3
InChIKeyCQYFBBSSNAPAMF-UHFFFAOYSA-N
XLogP8.58
TPSA0.00 Ų
H-Bond Donors
H-Bond Acceptors
Rotatable Bonds8
Heavy Atoms37
Complexity—

Lipinski Rule of Five

1 violation

RuleValue
MW ≤ 500496.77
LogP ≤ 58.58
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

bis[(2-methyl-1-phenylinden-1-yl)methyl]silane
CID 137328534
9-ethyl-9-phenyl-10-(4-phenylphenyl)acridine
CID 71004140
1,1,2-triphenylindene
CID 102483924
1-(4-ethylphenyl)-1-phenylindene
CID 139709791
9,9-diphenylfluorene;propane
CID 158205050
3-ethyl-2,2-diphenylphosphirene
CID 150297665
1,2-dimethyl-1-(4-methylphenyl)indene
CID 143243709
bis(9,9-diphenylfluorene);ethane;propane
CID 144938803
bicyclo[2.2.0]hexa-1,3,5-triene;ethylbenzene
CID 175075360
9-(4-ethylphenyl)-9-phenylfluorene
CID 149284542
N,N-bis[4-[4-(1,1-dimethylinden-2-yl)phenyl]phenyl]-4-phenylaniline
CID 164744849
propane;spiro[fluorene-9,6'-tricyclo[5.2.2.22,5]trideca-1(10),2(13),3,5(12),7(11),8-hexaene]
CID 144938761

Frequently Asked Questions

What is the IUPAC name of bis[(2-ethyl-1-phenylinden-1-yl)methyl]silane?
The IUPAC name of bis[(2-ethyl-1-phenylinden-1-yl)methyl]silane (CID 137328470) is bis[(2-ethyl-1-phenylinden-1-yl)methyl]silane.
What is the SMILES notation for bis[(2-ethyl-1-phenylinden-1-yl)methyl]silane?
The canonical SMILES for bis[(2-ethyl-1-phenylinden-1-yl)methyl]silane is CCC1=Cc2ccccc2C1(C[SiH2]CC1(c2ccccc2)C(CC)=Cc2ccccc21)c1ccccc1.
What is the InChIKey of bis[(2-ethyl-1-phenylinden-1-yl)methyl]silane?
The InChIKey is CQYFBBSSNAPAMF-UHFFFAOYSA-N. The full InChI is InChI=1S/C36H36Si/c1-3-29-23-27-15-11-13-21-33(27)35(29,31-17-7-5-8-18-31)25-37-26-36(32-19-9-6-10-20-32)30(4-2)24-28-16-12-14-22-34(28)36/h5-24H,3-4,25-26,37H2,1-2H3.
What are the key properties of bis[(2-ethyl-1-phenylinden-1-yl)methyl]silane?
bis[(2-ethyl-1-phenylinden-1-yl)methyl]silane has a molecular weight of 496.77 g/mol, XLogP of 8.58, 8 rotatable bonds, 0 hydrogen bond donors, and 0 hydrogen bond acceptors.
Where does this data come from?
All data for bis[(2-ethyl-1-phenylinden-1-yl)methyl]silane is sourced from PubChem (CID 137328470), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).