(4-anthracen-9-yl-2-methyl-2,3,3a,7a-tetrahydro-1H-inden-1-yl)-dimethyl-(2,3,4,5-tetramethylcyclopentyl)silane

C35H44Si — CID 162694927

IUPAC(4-anthracen-9-yl-2-methyl-2,3,3a,7a-tetrahydro-1H-inden-1-yl)-dimethyl-(2,3,4,5-tetramethylcyclopentyl)silane
SMILESCC1CC2C(c3c4ccccc4cc4ccccc34)=CC=CC2C1[Si](C)(C)C1C(C)C(C)C(C)C1C
InChIInChI=1S/C35H44Si/c1-21-19-32-30(33-28-15-10-8-13-26(28)20-27-14-9-11-16-29(27)33)17-12-18-31(32)34(21)36(6,7)35-24(4)22(2)23(3)25(35)5/h8-18,20-25,31-32,34-35H,19H2,1-7H3
InChIKeyQSZJWKDIYSRUDM-UHFFFAOYSA-N
MW492.82 g/mol
LogP10.23
Rot. Bonds3

About (4-anthracen-9-yl-2-methyl-2,3,3a,7a-tetrahydro-1H-inden-1-yl)-dimethyl-(2,3,4,5-tetramethylcyclopentyl)silane

(4-anthracen-9-yl-2-methyl-2,3,3a,7a-tetrahydro-1H-inden-1-yl)-dimethyl-(2,3,4,5-tetramethylcyclopentyl)silane (PubChem CID 162694927) has the molecular formula C35H44Si and a molecular weight of 492.82 g/mol. Its IUPAC name is (4-anthracen-9-yl-2-methyl-2,3,3a,7a-tetrahydro-1H-inden-1-yl)-dimethyl-(2,3,4,5-tetramethylcyclopentyl)silane.

Molecular Properties

Compound Name(4-anthracen-9-yl-2-methyl-2,3,3a,7a-tetrahydro-1H-inden-1-yl)-dimethyl-(2,3,4,5-tetramethylcyclopentyl)silane
PubChem CID162694927
Molecular FormulaC35H44Si
Molecular Weight492.82 g/mol
Exact Mass492.32
IUPAC Name(4-anthracen-9-yl-2-methyl-2,3,3a,7a-tetrahydro-1H-inden-1-yl)-dimethyl-(2,3,4,5-tetramethylcyclopentyl)silane
SMILESCC1CC2C(c3c4ccccc4cc4ccccc34)=CC=CC2C1[Si](C)(C)C1C(C)C(C)C(C)C1C
InChIInChI=1S/C35H44Si/c1-21-19-32-30(33-28-15-10-8-13-26(28)20-27-14-9-11-16-29(27)33)17-12-18-31(32)34(21)36(6,7)35-24(4)22(2)23(3)25(35)5/h8-18,20-25,31-32,34-35H,19H2,1-7H3
InChIKeyQSZJWKDIYSRUDM-UHFFFAOYSA-N
XLogP10.23
TPSA0.00 Ų
H-Bond Donors
H-Bond Acceptors
Rotatable Bonds3
Heavy Atoms36
Complexity—

Lipinski Rule of Five

1 violation

RuleValue
MW ≤ 500492.82
LogP ≤ 510.23
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 100

Computed Properties (RDKit)

Structural Alerts{'alert_name': 'heavy_metal', 'substructure': 'N/A'}, {'alert_name': 'Polycyclic_aromatic_hydrocarbon_2', 'substructure': 'N/A'}

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Related Compounds

carbanide;[4-(3,5-ditert-butyl-4-methoxyphenyl)-2-methyl-2,3,3a,7a-tetrahydro-1H-inden-1-yl]-dimethyl-[4-(2-phenylphenyl)-2-propan-2-yl-2,3,3a,7a-tetrahydro-1H-inden-1-yl]silane;zirconium(4+)
CID 162293972
bis(4-carbazol-9-yl-2-methyl-2,3,3a,7a-tetrahydro-1H-inden-1-yl)-dimethylsilane;bis(4-indol-1-yl-2-methyl-2,3,3a,7a-tetrahydro-1H-inden-1-yl)-dimethylsilane;carbanide;bis(dichlorozirconium(2+));dimethyl-bis(2-methyl-4-pyrrol-1-yl-2,3,3a,7a-tetrahydro-1H-inden-1-yl)silane;zirconium(4+)
CID 162298066
dimethyl-(2-methyl-4-pyridin-2-yl-2,3,3a,7a-tetrahydro-1H-inden-1-yl)-piperazin-1-ylsilane
CID 58634095
[4-(3,5-ditert-butyl-4-methylphenyl)-2-methyl-2,3,3a,7a-tetrahydro-1H-inden-1-yl]-[2-hexyl-4-(2-phenylphenyl)-2,3,3a,7a-tetrahydro-1H-inden-1-yl]-dimethylsilane
CID 162270332
bis[4-(4-tert-butylphenyl)-2-methyl-2,3,3a,7a-tetrahydro-1H-inden-1-yl]-methyl-propylsilane
CID 156627158
[4-(4-tert-butylphenyl)-2-propan-2-yl-2,3,3a,7a-tetrahydro-1H-inden-1-yl]-dimethyl-(2-methyl-4,8-diphenyl-1,2,3,3a,5,6,7,8a-octahydro-s-indacen-1-yl)silane
CID 72574460
[(7aR)-4-anthracen-9-yl-2,2-dimethyl-3a,7a-dihydrobenzimidazol-3-id-1-yl]-(2,7-ditert-butyl-4b,8a,9,9a-tetrahydro-4aH-fluoren-9-yl)-dimethylsilane;carbanide;dichlorotitanium
CID 58634749
bis[4-(4-tert-butylphenyl)-2-ethyl-2,3,3a,7a-tetrahydro-1H-inden-1-yl]-dimethylsilane
CID 59227036
carbanide;dichlorozirconium(2+);(1,3-dimethyl-2,3,3a,7a-tetrahydro-1H-inden-2-yl)-(4,7-dimethyl-2-phenyl-2,3,3a,7a-tetrahydro-1H-inden-1-yl)-dimethylsilane
CID 162286836
carbanide;dichlorozirconium(2+);(1,3-dimethyl-2,3,3a,7a-tetrahydro-1H-inden-2-yl)-dimethyl-(3-phenyl-2,3,3a,7a-tetrahydro-1H-inden-1-yl)silane
CID 162298306
(1,3-dimethyl-2,3,3a,7a-tetrahydro-1H-inden-2-yl)-[2-(3,5-dimethylphenyl)-2,3,3a,7a-tetrahydro-1H-inden-1-yl]-dimethylsilane
CID 156675178
2,4,6-tri(anthracen-9-yl)-1,3,5-triazine
CID 59336460

Frequently Asked Questions

What is the IUPAC name of (4-anthracen-9-yl-2-methyl-2,3,3a,7a-tetrahydro-1H-inden-1-yl)-dimethyl-(2,3,4,5-tetramethylcyclopentyl)silane?
The IUPAC name of (4-anthracen-9-yl-2-methyl-2,3,3a,7a-tetrahydro-1H-inden-1-yl)-dimethyl-(2,3,4,5-tetramethylcyclopentyl)silane (CID 162694927) is (4-anthracen-9-yl-2-methyl-2,3,3a,7a-tetrahydro-1H-inden-1-yl)-dimethyl-(2,3,4,5-tetramethylcyclopentyl)silane.
What is the SMILES notation for (4-anthracen-9-yl-2-methyl-2,3,3a,7a-tetrahydro-1H-inden-1-yl)-dimethyl-(2,3,4,5-tetramethylcyclopentyl)silane?
The canonical SMILES for (4-anthracen-9-yl-2-methyl-2,3,3a,7a-tetrahydro-1H-inden-1-yl)-dimethyl-(2,3,4,5-tetramethylcyclopentyl)silane is CC1CC2C(c3c4ccccc4cc4ccccc34)=CC=CC2C1[Si](C)(C)C1C(C)C(C)C(C)C1C.
What is the InChIKey of (4-anthracen-9-yl-2-methyl-2,3,3a,7a-tetrahydro-1H-inden-1-yl)-dimethyl-(2,3,4,5-tetramethylcyclopentyl)silane?
The InChIKey is QSZJWKDIYSRUDM-UHFFFAOYSA-N. The full InChI is InChI=1S/C35H44Si/c1-21-19-32-30(33-28-15-10-8-13-26(28)20-27-14-9-11-16-29(27)33)17-12-18-31(32)34(21)36(6,7)35-24(4)22(2)23(3)25(35)5/h8-18,20-25,31-32,34-35H,19H2,1-7H3.
What are the key properties of (4-anthracen-9-yl-2-methyl-2,3,3a,7a-tetrahydro-1H-inden-1-yl)-dimethyl-(2,3,4,5-tetramethylcyclopentyl)silane?
(4-anthracen-9-yl-2-methyl-2,3,3a,7a-tetrahydro-1H-inden-1-yl)-dimethyl-(2,3,4,5-tetramethylcyclopentyl)silane has a molecular weight of 492.82 g/mol, XLogP of 10.23, 3 rotatable bonds, 0 hydrogen bond donors, and 0 hydrogen bond acceptors.
Where does this data come from?
All data for (4-anthracen-9-yl-2-methyl-2,3,3a,7a-tetrahydro-1H-inden-1-yl)-dimethyl-(2,3,4,5-tetramethylcyclopentyl)silane is sourced from PubChem (CID 162694927), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).