[(4aR,9aS)-10-trimethylsilyl-1,2,3,4,4a,5,6,7,8,9a-decahydroanthracen-9-yl]-trimethylsilane

C20H36Si2 — CID 134832827

IUPAC[(4aR,9aS)-10-trimethylsilyl-1,2,3,4,4a,5,6,7,8,9a-decahydroanthracen-9-yl]-trimethylsilane
SMILESC[Si](C)(C)C1=C2CCCCC2=C([Si](C)(C)C)[C@@H]2CCCC[C@H]12
InChIInChI=1S/C20H36Si2/c1-21(2,3)19-15-11-7-9-13-17(15)20(22(4,5)6)18-14-10-8-12-16(18)19/h15,17H,7-14H2,1-6H3/t15-,17+
InChIKeyUZSIWGNJYSEBFC-WOVMCDHWSA-N
MW332.68 g/mol
LogP6.73
Rot. Bonds2

About [(4aR,9aS)-10-trimethylsilyl-1,2,3,4,4a,5,6,7,8,9a-decahydroanthracen-9-yl]-trimethylsilane

[(4aR,9aS)-10-trimethylsilyl-1,2,3,4,4a,5,6,7,8,9a-decahydroanthracen-9-yl]-trimethylsilane (PubChem CID 134832827) has the molecular formula C20H36Si2 and a molecular weight of 332.68 g/mol. Its IUPAC name is [(4aR,9aS)-10-trimethylsilyl-1,2,3,4,4a,5,6,7,8,9a-decahydroanthracen-9-yl]-trimethylsilane.

Molecular Properties

Compound Name[(4aR,9aS)-10-trimethylsilyl-1,2,3,4,4a,5,6,7,8,9a-decahydroanthracen-9-yl]-trimethylsilane
PubChem CID134832827
Molecular FormulaC20H36Si2
Molecular Weight332.68 g/mol
Exact Mass332.24
IUPAC Name[(4aR,9aS)-10-trimethylsilyl-1,2,3,4,4a,5,6,7,8,9a-decahydroanthracen-9-yl]-trimethylsilane
SMILESC[Si](C)(C)C1=C2CCCCC2=C([Si](C)(C)C)[C@@H]2CCCC[C@H]12
InChIInChI=1S/C20H36Si2/c1-21(2,3)19-15-11-7-9-13-17(15)20(22(4,5)6)18-14-10-8-12-16(18)19/h15,17H,7-14H2,1-6H3/t15-,17+
InChIKeyUZSIWGNJYSEBFC-WOVMCDHWSA-N
XLogP6.73
TPSA0.00 Ų
H-Bond Donors
H-Bond Acceptors
Rotatable Bonds2
Heavy Atoms22
Complexity—

Lipinski Rule of Five

1 violation

RuleValue
MW ≤ 500332.68
LogP ≤ 56.73
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

[(2R,3R)-2,3-dipropyl-4-trimethylsilyl-2,3,5,6,7,8-hexahydronaphthalen-1-yl]-trimethylsilane
CID 101514007
[(4aS,8aS)-1-(2-methylprop-1-enyl)-3,4,4a,5,6,7,8,8a-octahydronaphthalen-2-yl]methyl-tris(trimethylsilyl)silane
CID 102298564
[(2S,3R)-2,3-dipropyl-4-trimethylsilyl-2,3,5,6,7,8-hexahydronaphthalen-1-yl]-trimethylsilane
CID 134832828
(1,2,3,4,5,6,7,8,10,10a-Decahydrophenanthren-9-yl)(trimethyl)silane
CID 13273618
9,10-Dimethyl-1,2,3,4,4a,5,6,7,8,9a-decahydroanthracene
CID 57567805
[(4aR,8aS)-4-trimethylsilyl-4a,5,6,7,8,8a-hexahydronaphthalen-1-yl]-trimethylsilane
CID 11076786
[(10aR)-1,2,3,4,5,6,7,8,10,10a-decahydrophenanthren-9-yl]-trimethylsilane
CID 13273621
[(10aS)-1,2,3,4,5,6,7,8,10,10a-decahydrophenanthren-9-yl]-trimethylsilane
CID 13273623

Frequently Asked Questions

What is the IUPAC name of [(4aR,9aS)-10-trimethylsilyl-1,2,3,4,4a,5,6,7,8,9a-decahydroanthracen-9-yl]-trimethylsilane?
The IUPAC name of [(4aR,9aS)-10-trimethylsilyl-1,2,3,4,4a,5,6,7,8,9a-decahydroanthracen-9-yl]-trimethylsilane (CID 134832827) is [(4aR,9aS)-10-trimethylsilyl-1,2,3,4,4a,5,6,7,8,9a-decahydroanthracen-9-yl]-trimethylsilane.
What is the SMILES notation for [(4aR,9aS)-10-trimethylsilyl-1,2,3,4,4a,5,6,7,8,9a-decahydroanthracen-9-yl]-trimethylsilane?
The canonical SMILES for [(4aR,9aS)-10-trimethylsilyl-1,2,3,4,4a,5,6,7,8,9a-decahydroanthracen-9-yl]-trimethylsilane is C[Si](C)(C)C1=C2CCCCC2=C([Si](C)(C)C)[C@@H]2CCCC[C@H]12.
What is the InChIKey of [(4aR,9aS)-10-trimethylsilyl-1,2,3,4,4a,5,6,7,8,9a-decahydroanthracen-9-yl]-trimethylsilane?
The InChIKey is UZSIWGNJYSEBFC-WOVMCDHWSA-N. The full InChI is InChI=1S/C20H36Si2/c1-21(2,3)19-15-11-7-9-13-17(15)20(22(4,5)6)18-14-10-8-12-16(18)19/h15,17H,7-14H2,1-6H3/t15-,17+.
What are the key properties of [(4aR,9aS)-10-trimethylsilyl-1,2,3,4,4a,5,6,7,8,9a-decahydroanthracen-9-yl]-trimethylsilane?
[(4aR,9aS)-10-trimethylsilyl-1,2,3,4,4a,5,6,7,8,9a-decahydroanthracen-9-yl]-trimethylsilane has a molecular weight of 332.68 g/mol, XLogP of 6.73, 2 rotatable bonds, 0 hydrogen bond donors, and 0 hydrogen bond acceptors.
Where does this data come from?
All data for [(4aR,9aS)-10-trimethylsilyl-1,2,3,4,4a,5,6,7,8,9a-decahydroanthracen-9-yl]-trimethylsilane is sourced from PubChem (CID 134832827), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).