[(E,3E)-2-butyl-3-(trimethylsilylmethylidene)hept-1-enyl]-trimethylsilane

C18H38Si2 — CID 101369879

IUPAC[(E,3E)-2-butyl-3-(trimethylsilylmethylidene)hept-1-enyl]-trimethylsilane
SMILESCCCCC(=C\[Si](C)(C)C)/C(=C/[Si](C)(C)C)CCCC
InChIInChI=1S/C18H38Si2/c1-9-11-13-17(15-19(3,4)5)18(14-12-10-2)16-20(6,7)8/h15-16H,9-14H2,1-8H3/b17-15+,18-16+
InChIKeyHFIWAHPMQHWSAC-YTEMWHBBSA-N
MW310.67 g/mol
LogP6.97
Rot. Bonds9

About [(E,3E)-2-butyl-3-(trimethylsilylmethylidene)hept-1-enyl]-trimethylsilane

[(E,3E)-2-butyl-3-(trimethylsilylmethylidene)hept-1-enyl]-trimethylsilane (PubChem CID 101369879) has the molecular formula C18H38Si2 and a molecular weight of 310.67 g/mol. Its IUPAC name is [(E,3E)-2-butyl-3-(trimethylsilylmethylidene)hept-1-enyl]-trimethylsilane.

Molecular Properties

Compound Name[(E,3E)-2-butyl-3-(trimethylsilylmethylidene)hept-1-enyl]-trimethylsilane
PubChem CID101369879
Molecular FormulaC18H38Si2
Molecular Weight310.67 g/mol
Exact Mass310.25
IUPAC Name[(E,3E)-2-butyl-3-(trimethylsilylmethylidene)hept-1-enyl]-trimethylsilane
SMILESCCCCC(=C\[Si](C)(C)C)/C(=C/[Si](C)(C)C)CCCC
InChIInChI=1S/C18H38Si2/c1-9-11-13-17(15-19(3,4)5)18(14-12-10-2)16-20(6,7)8/h15-16H,9-14H2,1-8H3/b17-15+,18-16+
InChIKeyHFIWAHPMQHWSAC-YTEMWHBBSA-N
XLogP6.97
TPSA0.00 Ų
H-Bond Donors
H-Bond Acceptors
Rotatable Bonds9
Heavy Atoms20
Complexity—

Lipinski Rule of Five

1 violation

RuleValue
MW ≤ 500310.67
LogP ≤ 56.97
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 100

Computed Properties (RDKit)

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

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Related Compounds

trimethyl-[(E)-2-methyloct-1-enyl]silane
CID 10035643
[(E)-2-ethyloct-1-enyl]-trimethylsilane
CID 10081920
Trimethyl(1-trimethylsilyldec-1-enyl)silane
CID 11011529
[(E)-3-butyl-2-methyl-5-methylidenenon-2-enyl]-triethylsilane
CID 101777994
Triisopropyl(3-methylenenon-1-yn-1-yl)silane
CID 102088940
Trimethyl(3-methylidenenonyl)silane
CID 10584673
Dilithium;[2-hexyl-3-(trimethylsilylmethylidene)non-1-enyl]-trimethylsilane
CID 11153168
trimethyl-[(Z)-2-methyloct-1-enyl]silane
CID 12426804
[(Z)-2-ethyloct-1-enyl]-trimethylsilane
CID 12458688
Trimethyl(2-methylidenenonyl)silane
CID 13979642
Bis(trimethylsilylmethylidene)cycloheptane
CID 14469948
trimethyl-[(E)-3-methylidenenon-1-enyl]silane
CID 14617633

Frequently Asked Questions

What is the IUPAC name of [(E,3E)-2-butyl-3-(trimethylsilylmethylidene)hept-1-enyl]-trimethylsilane?
The IUPAC name of [(E,3E)-2-butyl-3-(trimethylsilylmethylidene)hept-1-enyl]-trimethylsilane (CID 101369879) is [(E,3E)-2-butyl-3-(trimethylsilylmethylidene)hept-1-enyl]-trimethylsilane.
What is the SMILES notation for [(E,3E)-2-butyl-3-(trimethylsilylmethylidene)hept-1-enyl]-trimethylsilane?
The canonical SMILES for [(E,3E)-2-butyl-3-(trimethylsilylmethylidene)hept-1-enyl]-trimethylsilane is CCCCC(=C\[Si](C)(C)C)/C(=C/[Si](C)(C)C)CCCC.
What is the InChIKey of [(E,3E)-2-butyl-3-(trimethylsilylmethylidene)hept-1-enyl]-trimethylsilane?
The InChIKey is HFIWAHPMQHWSAC-YTEMWHBBSA-N. The full InChI is InChI=1S/C18H38Si2/c1-9-11-13-17(15-19(3,4)5)18(14-12-10-2)16-20(6,7)8/h15-16H,9-14H2,1-8H3/b17-15+,18-16+.
What are the key properties of [(E,3E)-2-butyl-3-(trimethylsilylmethylidene)hept-1-enyl]-trimethylsilane?
[(E,3E)-2-butyl-3-(trimethylsilylmethylidene)hept-1-enyl]-trimethylsilane has a molecular weight of 310.67 g/mol, XLogP of 6.97, 9 rotatable bonds, 0 hydrogen bond donors, and 0 hydrogen bond acceptors.
Where does this data come from?
All data for [(E,3E)-2-butyl-3-(trimethylsilylmethylidene)hept-1-enyl]-trimethylsilane is sourced from PubChem (CID 101369879), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).