dilithium;(2-butyl-3-propylhepta-1,3-dienyl)-trimethylsilane

C17H32Li2Si — CID 134888103

IUPACdilithium;(2-butyl-3-propylhepta-1,3-dienyl)-trimethylsilane
SMILESCCC/[C-]=C(CCC)/C(=[C-]/[Si](C)(C)C)CCCC.[Li+].[Li+]
InChIInChI=1S/C17H32Si.2Li/c1-7-10-13-16(12-9-3)17(14-11-8-2)15-18(4,5)6;;/h7-12,14H2,1-6H3;;/q-2;2*+1
InChIKeyJTTYONOWWPDJEU-UHFFFAOYSA-N
MW278.41 g/mol
LogP0.12
Rot. Bonds9

About dilithium;(2-butyl-3-propylhepta-1,3-dienyl)-trimethylsilane

dilithium;(2-butyl-3-propylhepta-1,3-dienyl)-trimethylsilane (PubChem CID 134888103) has the molecular formula C17H32Li2Si and a molecular weight of 278.41 g/mol. Its IUPAC name is dilithium;(2-butyl-3-propylhepta-1,3-dienyl)-trimethylsilane.

Molecular Properties

Compound Namedilithium;(2-butyl-3-propylhepta-1,3-dienyl)-trimethylsilane
PubChem CID134888103
Molecular FormulaC17H32Li2Si
Molecular Weight278.41 g/mol
Exact Mass278.26
IUPAC Namedilithium;(2-butyl-3-propylhepta-1,3-dienyl)-trimethylsilane
SMILESCCC/[C-]=C(CCC)/C(=[C-]/[Si](C)(C)C)CCCC.[Li+].[Li+]
InChIInChI=1S/C17H32Si.2Li/c1-7-10-13-16(12-9-3)17(14-11-8-2)15-18(4,5)6;;/h7-12,14H2,1-6H3;;/q-2;2*+1
InChIKeyJTTYONOWWPDJEU-UHFFFAOYSA-N
XLogP0.12
TPSA0.00 Ų
H-Bond Donors
H-Bond Acceptors
Rotatable Bonds9
Heavy Atoms20
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500278.41
LogP ≤ 50.12
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 100

Computed Properties (RDKit)

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

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Related Compounds

Dilithium;[2-hexyl-3-(trimethylsilylmethylidene)non-1-enyl]-trimethylsilane
CID 11153168
trimethyl-[(2E)-5-pentyldeca-2,4-dienyl]silane
CID 11196759
1,1-Dimethyl-2,3,4,5-tetrapropylsilacyclopenta-2,4-diene
CID 12190885
Dilithium;6,7-dibutyldodeca-5,7-diene
CID 12982544
1,1-Dimethyl-2,4-dioctylsilole
CID 101836332
3,4-Dihexyl-1,1-dimethyl-2,5-dihydrosilole
CID 101851275
2,4-Dihexyl-1,1-dimethylsilole
CID 102088905
[1-Deutero-2-(2-deutero1-cycloocten-1-yl)-hex-1-en-1-yl](trimethyl)silane
CID 129754933
(2-1-Cycloocten-1-yl-hex-1-en-1-yl)(trimethyl)-silane
CID 129755114
[(1Z,3Z)-2-butyl-1,4-diiodo-3-propylhepta-1,3-dienyl]-trimethylsilane
CID 134888022
Dilithium;[2-butyl-3-(trimethylsilylmethylidene)hept-1-enyl]-trimethylsilane
CID 134888331
trimethyl-[(2Z)-5-pentyldeca-2,4-dienyl]silane
CID 134993775

Frequently Asked Questions

What is the IUPAC name of dilithium;(2-butyl-3-propylhepta-1,3-dienyl)-trimethylsilane?
The IUPAC name of dilithium;(2-butyl-3-propylhepta-1,3-dienyl)-trimethylsilane (CID 134888103) is dilithium;(2-butyl-3-propylhepta-1,3-dienyl)-trimethylsilane.
What is the SMILES notation for dilithium;(2-butyl-3-propylhepta-1,3-dienyl)-trimethylsilane?
The canonical SMILES for dilithium;(2-butyl-3-propylhepta-1,3-dienyl)-trimethylsilane is CCC/[C-]=C(CCC)/C(=[C-]/[Si](C)(C)C)CCCC.[Li+].[Li+].
What is the InChIKey of dilithium;(2-butyl-3-propylhepta-1,3-dienyl)-trimethylsilane?
The InChIKey is JTTYONOWWPDJEU-UHFFFAOYSA-N. The full InChI is InChI=1S/C17H32Si.2Li/c1-7-10-13-16(12-9-3)17(14-11-8-2)15-18(4,5)6;;/h7-12,14H2,1-6H3;;/q-2;2*+1.
What are the key properties of dilithium;(2-butyl-3-propylhepta-1,3-dienyl)-trimethylsilane?
dilithium;(2-butyl-3-propylhepta-1,3-dienyl)-trimethylsilane has a molecular weight of 278.41 g/mol, XLogP of 0.12, 9 rotatable bonds, 0 hydrogen bond donors, and 0 hydrogen bond acceptors.
Where does this data come from?
All data for dilithium;(2-butyl-3-propylhepta-1,3-dienyl)-trimethylsilane is sourced from PubChem (CID 134888103), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).