dimethyl-bis(3-methyl-1,2-diphenyl-3H-inden-4-yl)germane

C46H40Ge — CID 139707783

IUPACdimethyl-bis(3-methyl-1,2-diphenyl-3H-inden-4-yl)germane
SMILESCC1C(c2ccccc2)=C(c2ccccc2)c2cccc([Ge](C)(C)c3cccc4c3C(C)C(c3ccccc3)=C4c3ccccc3)c21
InChIInChI=1S/C46H40Ge/c1-31-41(33-19-9-5-10-20-33)45(35-23-13-7-14-24-35)37-27-17-29-39(43(31)37)47(3,4)40-30-18-28-38-44(40)32(2)42(34-21-11-6-12-22-34)46(38)36-25-15-8-16-26-36/h5-32H,1-4H3
InChIKeyTVHFETXUAGNKGX-UHFFFAOYSA-N
MW665.44 g/mol
LogP10.66
Rot. Bonds6

About dimethyl-bis(3-methyl-1,2-diphenyl-3H-inden-4-yl)germane

dimethyl-bis(3-methyl-1,2-diphenyl-3H-inden-4-yl)germane (PubChem CID 139707783) has the molecular formula C46H40Ge and a molecular weight of 665.44 g/mol. Its IUPAC name is dimethyl-bis(3-methyl-1,2-diphenyl-3H-inden-4-yl)germane.

Molecular Properties

Compound Namedimethyl-bis(3-methyl-1,2-diphenyl-3H-inden-4-yl)germane
PubChem CID139707783
Molecular FormulaC46H40Ge
Molecular Weight665.44 g/mol
Exact Mass666.23
IUPAC Namedimethyl-bis(3-methyl-1,2-diphenyl-3H-inden-4-yl)germane
SMILESCC1C(c2ccccc2)=C(c2ccccc2)c2cccc([Ge](C)(C)c3cccc4c3C(C)C(c3ccccc3)=C4c3ccccc3)c21
InChIInChI=1S/C46H40Ge/c1-31-41(33-19-9-5-10-20-33)45(35-23-13-7-14-24-35)37-27-17-29-39(43(31)37)47(3,4)40-30-18-28-38-44(40)32(2)42(34-21-11-6-12-22-34)46(38)36-25-15-8-16-26-36/h5-32H,1-4H3
InChIKeyTVHFETXUAGNKGX-UHFFFAOYSA-N
XLogP10.66
TPSA0.00 Ų
H-Bond Donors
H-Bond Acceptors
Rotatable Bonds6
Heavy Atoms47
Complexity—

Lipinski Rule of Five

2 violations

RuleValue
MW ≤ 500665.44
LogP ≤ 510.66
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 100

Computed Properties (RDKit)

Structural Alerts{'alert_name': 'stilbene', 'substructure': 'N/A'}

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Related Compounds

bis(3-methyl-1,2-diphenyl-3H-inden-4-yl)-diphenylsilane
CID 139707729
2-chloro-1-methyl-3-phenyl-1H-indene
CID 13149961
3-fluoro-1-methyl-2-phenyl-1H-indene
CID 86003078
2-(2,3-diphenylphenyl)-4,6-diphenyl-1,3,5-triazine
CID 171052479
1-methyl-3-phenyl-1H-indene-2-carboxylic acid
CID 177461610
N-(7-fluoro-2,3-diphenyl-1H-inden-1-yl)-4-methylbenzenesulfonamide
CID 102343066
1,7-dimethoxy-2-methyl-3-phenyl-1H-indene
CID 101034746
5-phenyl-10-[4-(5-phenylindeno[1,2-b]inden-10-yl)phenyl]indeno[2,1-a]indene
CID 177426395
[3-(2,3-dimethylcycloprop-2-en-1-yl)-2,4,5-triphenylcyclopenta-1,4-dien-1-yl]benzene
CID 134888097
2,4,6-tris(2,3-diphenylphenyl)-1,3,5-triazine
CID 171052343
1-bromo-2-(4-methoxyphenyl)-3-phenyl-1H-indene
CID 162400233
1-phenyl-2-(2,3,4,5-tetramethylcyclopenta-1,4-dien-1-yl)benzene
CID 141312079

Frequently Asked Questions

What is the IUPAC name of dimethyl-bis(3-methyl-1,2-diphenyl-3H-inden-4-yl)germane?
The IUPAC name of dimethyl-bis(3-methyl-1,2-diphenyl-3H-inden-4-yl)germane (CID 139707783) is dimethyl-bis(3-methyl-1,2-diphenyl-3H-inden-4-yl)germane.
What is the SMILES notation for dimethyl-bis(3-methyl-1,2-diphenyl-3H-inden-4-yl)germane?
The canonical SMILES for dimethyl-bis(3-methyl-1,2-diphenyl-3H-inden-4-yl)germane is CC1C(c2ccccc2)=C(c2ccccc2)c2cccc([Ge](C)(C)c3cccc4c3C(C)C(c3ccccc3)=C4c3ccccc3)c21.
What is the InChIKey of dimethyl-bis(3-methyl-1,2-diphenyl-3H-inden-4-yl)germane?
The InChIKey is TVHFETXUAGNKGX-UHFFFAOYSA-N. The full InChI is InChI=1S/C46H40Ge/c1-31-41(33-19-9-5-10-20-33)45(35-23-13-7-14-24-35)37-27-17-29-39(43(31)37)47(3,4)40-30-18-28-38-44(40)32(2)42(34-21-11-6-12-22-34)46(38)36-25-15-8-16-26-36/h5-32H,1-4H3.
What are the key properties of dimethyl-bis(3-methyl-1,2-diphenyl-3H-inden-4-yl)germane?
dimethyl-bis(3-methyl-1,2-diphenyl-3H-inden-4-yl)germane has a molecular weight of 665.44 g/mol, XLogP of 10.66, 6 rotatable bonds, 0 hydrogen bond donors, and 0 hydrogen bond acceptors.
Where does this data come from?
All data for dimethyl-bis(3-methyl-1,2-diphenyl-3H-inden-4-yl)germane is sourced from PubChem (CID 139707783), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).