hex-5-enyl-[(1R)-3-[hex-5-enyl(dimethyl)silyl]-1H-inden-1-yl]-dimethylsilane

C25H40Si2 — CID 101408626

IUPAChex-5-enyl-[(1R)-3-[hex-5-enyl(dimethyl)silyl]-1H-inden-1-yl]-dimethylsilane
SMILESC=CCCCC[Si](C)(C)C1=C[C@@H]([Si](C)(C)CCCCC=C)c2ccccc21
InChIInChI=1S/C25H40Si2/c1-7-9-11-15-19-26(3,4)24-21-25(23-18-14-13-17-22(23)24)27(5,6)20-16-12-10-8-2/h7-8,13-14,17-18,21,24H,1-2,9-12,15-16,19-20H2,3-6H3/t24-/m1/s1
InChIKeyBLHNOCFLCPSPAM-XMMPIXPASA-N
MW396.77 g/mol
LogP8.38
Rot. Bonds12

About hex-5-enyl-[(1R)-3-[hex-5-enyl(dimethyl)silyl]-1H-inden-1-yl]-dimethylsilane

hex-5-enyl-[(1R)-3-[hex-5-enyl(dimethyl)silyl]-1H-inden-1-yl]-dimethylsilane (PubChem CID 101408626) has the molecular formula C25H40Si2 and a molecular weight of 396.77 g/mol. Its IUPAC name is hex-5-enyl-[(1R)-3-[hex-5-enyl(dimethyl)silyl]-1H-inden-1-yl]-dimethylsilane.

Molecular Properties

Compound Namehex-5-enyl-[(1R)-3-[hex-5-enyl(dimethyl)silyl]-1H-inden-1-yl]-dimethylsilane
PubChem CID101408626
Molecular FormulaC25H40Si2
Molecular Weight396.77 g/mol
Exact Mass396.27
IUPAC Namehex-5-enyl-[(1R)-3-[hex-5-enyl(dimethyl)silyl]-1H-inden-1-yl]-dimethylsilane
SMILESC=CCCCC[Si](C)(C)C1=C[C@@H]([Si](C)(C)CCCCC=C)c2ccccc21
InChIInChI=1S/C25H40Si2/c1-7-9-11-15-19-26(3,4)24-21-25(23-18-14-13-17-22(23)24)27(5,6)20-16-12-10-8-2/h7-8,13-14,17-18,21,24H,1-2,9-12,15-16,19-20H2,3-6H3/t24-/m1/s1
InChIKeyBLHNOCFLCPSPAM-XMMPIXPASA-N
XLogP8.38
TPSA0.00 Ų
H-Bond Donors
H-Bond Acceptors
Rotatable Bonds12
Heavy Atoms27
Complexity—

Lipinski Rule of Five

1 violation

RuleValue
MW ≤ 500396.77
LogP ≤ 58.38
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 100

Computed Properties (RDKit)

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

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Frequently Asked Questions

What is the IUPAC name of hex-5-enyl-[(1R)-3-[hex-5-enyl(dimethyl)silyl]-1H-inden-1-yl]-dimethylsilane?
The IUPAC name of hex-5-enyl-[(1R)-3-[hex-5-enyl(dimethyl)silyl]-1H-inden-1-yl]-dimethylsilane (CID 101408626) is hex-5-enyl-[(1R)-3-[hex-5-enyl(dimethyl)silyl]-1H-inden-1-yl]-dimethylsilane.
What is the SMILES notation for hex-5-enyl-[(1R)-3-[hex-5-enyl(dimethyl)silyl]-1H-inden-1-yl]-dimethylsilane?
The canonical SMILES for hex-5-enyl-[(1R)-3-[hex-5-enyl(dimethyl)silyl]-1H-inden-1-yl]-dimethylsilane is C=CCCCC[Si](C)(C)C1=C[C@@H]([Si](C)(C)CCCCC=C)c2ccccc21.
What is the InChIKey of hex-5-enyl-[(1R)-3-[hex-5-enyl(dimethyl)silyl]-1H-inden-1-yl]-dimethylsilane?
The InChIKey is BLHNOCFLCPSPAM-XMMPIXPASA-N. The full InChI is InChI=1S/C25H40Si2/c1-7-9-11-15-19-26(3,4)24-21-25(23-18-14-13-17-22(23)24)27(5,6)20-16-12-10-8-2/h7-8,13-14,17-18,21,24H,1-2,9-12,15-16,19-20H2,3-6H3/t24-/m1/s1.
What are the key properties of hex-5-enyl-[(1R)-3-[hex-5-enyl(dimethyl)silyl]-1H-inden-1-yl]-dimethylsilane?
hex-5-enyl-[(1R)-3-[hex-5-enyl(dimethyl)silyl]-1H-inden-1-yl]-dimethylsilane has a molecular weight of 396.77 g/mol, XLogP of 8.38, 12 rotatable bonds, 0 hydrogen bond donors, and 0 hydrogen bond acceptors.
Where does this data come from?
All data for hex-5-enyl-[(1R)-3-[hex-5-enyl(dimethyl)silyl]-1H-inden-1-yl]-dimethylsilane is sourced from PubChem (CID 101408626), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).