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

C17H28Si — CID 13273621

IUPAC[(10aR)-1,2,3,4,5,6,7,8,10,10a-decahydrophenanthren-9-yl]-trimethylsilane
SMILESC[Si](C)(C)C1=C2CCCCC2=C2CCCC[C@@H]2C1
InChIInChI=1S/C17H28Si/c1-18(2,3)17-12-13-8-4-5-9-14(13)15-10-6-7-11-16(15)17/h13H,4-12H2,1-3H3/t13-/m1/s1
InChIKeyMHVRHWVKESVSHI-CYBMUJFWSA-N
MW260.50 g/mol
LogP5.62
Rot. Bonds1

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

[(10aR)-1,2,3,4,5,6,7,8,10,10a-decahydrophenanthren-9-yl]-trimethylsilane (PubChem CID 13273621) has the molecular formula C17H28Si and a molecular weight of 260.50 g/mol. Its IUPAC name is [(10aR)-1,2,3,4,5,6,7,8,10,10a-decahydrophenanthren-9-yl]-trimethylsilane.

Molecular Properties

Compound Name[(10aR)-1,2,3,4,5,6,7,8,10,10a-decahydrophenanthren-9-yl]-trimethylsilane
PubChem CID13273621
Molecular FormulaC17H28Si
Molecular Weight260.50 g/mol
Exact Mass260.20
IUPAC Name[(10aR)-1,2,3,4,5,6,7,8,10,10a-decahydrophenanthren-9-yl]-trimethylsilane
SMILESC[Si](C)(C)C1=C2CCCCC2=C2CCCC[C@@H]2C1
InChIInChI=1S/C17H28Si/c1-18(2,3)17-12-13-8-4-5-9-14(13)15-10-6-7-11-16(15)17/h13H,4-12H2,1-3H3/t13-/m1/s1
InChIKeyMHVRHWVKESVSHI-CYBMUJFWSA-N
XLogP5.62
TPSA0.00 Ų
H-Bond Donors
H-Bond Acceptors
Rotatable Bonds1
Heavy Atoms18
Complexity—

Lipinski Rule of Five

1 violation

RuleValue
MW ≤ 500260.50
LogP ≤ 55.62
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

[(4aR,9aS)-10-trimethylsilyl-1,2,3,4,4a,5,6,7,8,9a-decahydroanthracen-9-yl]-trimethylsilane
CID 134832827
[(2R,3R)-2,3-dipropyl-4-trimethylsilyl-2,3,5,6,7,8-hexahydronaphthalen-1-yl]-trimethylsilane
CID 101514007
[(2S,3R)-2,3-dipropyl-4-trimethylsilyl-2,3,5,6,7,8-hexahydronaphthalen-1-yl]-trimethylsilane
CID 134832828
CID 134982360
CID 134982360
Trimethyl(2,3,3a,4,6,7,8,9-octahydro-1H-cyclopenta[a]naphthalen-5-yl)silane
CID 13273605
(1,2,3,4,5,6,7,8,10,10a-Decahydrophenanthren-9-yl)(trimethyl)silane
CID 13273618
[5-(3-Cyclohexylpropylidene)cyclohexa-1,3-dien-1-yl]-trimethylsilane
CID 172555604
[(1S,8aR)-4-trimethylsilyl-1,5,6,7,8,8a-hexahydronaphthalen-1-yl]-trimethylsilane
CID 11119434
(4,4a,5,6,7,8-Hexahydronaphthalen-2-yl)(trimethyl)silane
CID 13271349
[(3aR)-2,3,3a,4,6,7,8,9-octahydro-1H-cyclopenta[a]naphthalen-5-yl]-trimethylsilane
CID 13273608
[(10aS)-1,2,3,4,5,6,7,8,10,10a-decahydrophenanthren-9-yl]-trimethylsilane
CID 13273623
4,4a,5,6,7,8-Hexahydronaphthalen-4-ylium-2-yl(trimethyl)silane
CID 90487411

Frequently Asked Questions

What is the IUPAC name of [(10aR)-1,2,3,4,5,6,7,8,10,10a-decahydrophenanthren-9-yl]-trimethylsilane?
The IUPAC name of [(10aR)-1,2,3,4,5,6,7,8,10,10a-decahydrophenanthren-9-yl]-trimethylsilane (CID 13273621) is [(10aR)-1,2,3,4,5,6,7,8,10,10a-decahydrophenanthren-9-yl]-trimethylsilane.
What is the SMILES notation for [(10aR)-1,2,3,4,5,6,7,8,10,10a-decahydrophenanthren-9-yl]-trimethylsilane?
The canonical SMILES for [(10aR)-1,2,3,4,5,6,7,8,10,10a-decahydrophenanthren-9-yl]-trimethylsilane is C[Si](C)(C)C1=C2CCCCC2=C2CCCC[C@@H]2C1.
What is the InChIKey of [(10aR)-1,2,3,4,5,6,7,8,10,10a-decahydrophenanthren-9-yl]-trimethylsilane?
The InChIKey is MHVRHWVKESVSHI-CYBMUJFWSA-N. The full InChI is InChI=1S/C17H28Si/c1-18(2,3)17-12-13-8-4-5-9-14(13)15-10-6-7-11-16(15)17/h13H,4-12H2,1-3H3/t13-/m1/s1.
What are the key properties of [(10aR)-1,2,3,4,5,6,7,8,10,10a-decahydrophenanthren-9-yl]-trimethylsilane?
[(10aR)-1,2,3,4,5,6,7,8,10,10a-decahydrophenanthren-9-yl]-trimethylsilane has a molecular weight of 260.50 g/mol, XLogP of 5.62, 1 rotatable bonds, 0 hydrogen bond donors, and 0 hydrogen bond acceptors.
Where does this data come from?
All data for [(10aR)-1,2,3,4,5,6,7,8,10,10a-decahydrophenanthren-9-yl]-trimethylsilane is sourced from PubChem (CID 13273621), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).