trimethyl-[3-[tris(3-methylphenyl)methyl]cyclopenta-2,4-dien-1-yl]silane

C30H34Si — CID 161356088

IUPACtrimethyl-[3-[tris(3-methylphenyl)methyl]cyclopenta-2,4-dien-1-yl]silane
SMILESCc1cccc(C(C2=CC([Si](C)(C)C)C=C2)(c2cccc(C)c2)c2cccc(C)c2)c1
InChIInChI=1S/C30H34Si/c1-22-10-7-13-25(18-22)30(26-14-8-11-23(2)19-26,27-15-9-12-24(3)20-27)28-16-17-29(21-28)31(4,5)6/h7-21,29H,1-6H3
InChIKeyHQOGUVQARSZLHI-UHFFFAOYSA-N
MW422.69 g/mol
LogP8.15
Rot. Bonds5

About trimethyl-[3-[tris(3-methylphenyl)methyl]cyclopenta-2,4-dien-1-yl]silane

trimethyl-[3-[tris(3-methylphenyl)methyl]cyclopenta-2,4-dien-1-yl]silane (PubChem CID 161356088) has the molecular formula C30H34Si and a molecular weight of 422.69 g/mol. Its IUPAC name is trimethyl-[3-[tris(3-methylphenyl)methyl]cyclopenta-2,4-dien-1-yl]silane.

Molecular Properties

Compound Nametrimethyl-[3-[tris(3-methylphenyl)methyl]cyclopenta-2,4-dien-1-yl]silane
PubChem CID161356088
Molecular FormulaC30H34Si
Molecular Weight422.69 g/mol
Exact Mass422.24
IUPAC Nametrimethyl-[3-[tris(3-methylphenyl)methyl]cyclopenta-2,4-dien-1-yl]silane
SMILESCc1cccc(C(C2=CC([Si](C)(C)C)C=C2)(c2cccc(C)c2)c2cccc(C)c2)c1
InChIInChI=1S/C30H34Si/c1-22-10-7-13-25(18-22)30(26-14-8-11-23(2)19-26,27-15-9-12-24(3)20-27)28-16-17-29(21-28)31(4,5)6/h7-21,29H,1-6H3
InChIKeyHQOGUVQARSZLHI-UHFFFAOYSA-N
XLogP8.15
TPSA0.00 Ų
H-Bond Donors
H-Bond Acceptors
Rotatable Bonds5
Heavy Atoms31
Complexity—

Lipinski Rule of Five

1 violation

RuleValue
MW ≤ 500422.69
LogP ≤ 58.15
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 100

Computed Properties (RDKit)

Structural Alerts{'alert_name': 'heavy_metal', 'substructure': 'N/A'}, {'alert_name': 'triphenyl_methyl-silyl', 'substructure': 'N/A'}

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Related Compounds

(3-tert-butylcyclopenta-2,4-dien-1-yl)-tris(3-methylphenyl)silane
CID 140852310
1-[1,1,2,2,3,3-hexafluoro-3-(3-methylphenyl)propyl]-3-methylbenzene
CID 163492269
1-[(3,4-dimethylcyclopenta-2,4-dien-1-yl)-bis(3-methylphenyl)methyl]-3-methylbenzene
CID 157132628
[dihydroxy-(3-methylphenyl)methyl]sulfanyl-(3-methylphenyl)methanediol
CID 150288864
1-(3-methylphenyl)ethane-1,1-diamine
CID 70165024
3,3-difluoro-3-(3-methylphenyl)propanal
CID 105440977
1,1-difluoro-2-methyl-1-(3-methylphenyl)propan-2-amine
CID 105452057
1-(1,1-dichloroprop-2-enyl)-3-methylbenzene
CID 582368
1-(2-fluorobut-3-en-2-yl)-3-methylbenzene
CID 138579646
[[2-[bis(3-methylphenyl)-phosphanylmethyl]cyclobutyl]-bis(3-methylphenyl)methyl]phosphane
CID 19367737
1-methyl-3-[1,1,2,2-tetrafluoro-2-[4-(1,1,2,2-tetrafluoropropyl)phenyl]ethyl]benzene
CID 158300208
1-[3,5-diethyl-4,4-difluoro-5-(3-methylphenyl)heptan-3-yl]-3-methylbenzene
CID 137435813

Frequently Asked Questions

What is the IUPAC name of trimethyl-[3-[tris(3-methylphenyl)methyl]cyclopenta-2,4-dien-1-yl]silane?
The IUPAC name of trimethyl-[3-[tris(3-methylphenyl)methyl]cyclopenta-2,4-dien-1-yl]silane (CID 161356088) is trimethyl-[3-[tris(3-methylphenyl)methyl]cyclopenta-2,4-dien-1-yl]silane.
What is the SMILES notation for trimethyl-[3-[tris(3-methylphenyl)methyl]cyclopenta-2,4-dien-1-yl]silane?
The canonical SMILES for trimethyl-[3-[tris(3-methylphenyl)methyl]cyclopenta-2,4-dien-1-yl]silane is Cc1cccc(C(C2=CC([Si](C)(C)C)C=C2)(c2cccc(C)c2)c2cccc(C)c2)c1.
What is the InChIKey of trimethyl-[3-[tris(3-methylphenyl)methyl]cyclopenta-2,4-dien-1-yl]silane?
The InChIKey is HQOGUVQARSZLHI-UHFFFAOYSA-N. The full InChI is InChI=1S/C30H34Si/c1-22-10-7-13-25(18-22)30(26-14-8-11-23(2)19-26,27-15-9-12-24(3)20-27)28-16-17-29(21-28)31(4,5)6/h7-21,29H,1-6H3.
What are the key properties of trimethyl-[3-[tris(3-methylphenyl)methyl]cyclopenta-2,4-dien-1-yl]silane?
trimethyl-[3-[tris(3-methylphenyl)methyl]cyclopenta-2,4-dien-1-yl]silane has a molecular weight of 422.69 g/mol, XLogP of 8.15, 5 rotatable bonds, 0 hydrogen bond donors, and 0 hydrogen bond acceptors.
Where does this data come from?
All data for trimethyl-[3-[tris(3-methylphenyl)methyl]cyclopenta-2,4-dien-1-yl]silane is sourced from PubChem (CID 161356088), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).