dilithium;[3-[[dimethyl(pent-1-ynyl)silyl]methylidene]-2-propylhex-1-enyl]-dimethyl-pent-1-ynylsilane

C24H40Li2Si2 — CID 139249962

IUPACdilithium;[3-[[dimethyl(pent-1-ynyl)silyl]methylidene]-2-propylhex-1-enyl]-dimethyl-pent-1-ynylsilane
SMILESCCCC#C[Si](C)(C)/[C-]=C(CCC)/C(=[C-]/[Si](C)(C)C#CCCC)CCC.[Li+].[Li+]
InChIInChI=1S/C24H40Si2.2Li/c1-9-13-15-19-25(5,6)21-23(17-11-3)24(18-12-4)22-26(7,8)20-16-14-10-2;;/h9-14,17-18H2,1-8H3;;/q-2;2*+1
InChIKeyDQYBZJKTECEVKW-UHFFFAOYSA-N
MW398.64 g/mol
LogP1.23
Rot. Bonds9

About dilithium;[3-[[dimethyl(pent-1-ynyl)silyl]methylidene]-2-propylhex-1-enyl]-dimethyl-pent-1-ynylsilane

dilithium;[3-[[dimethyl(pent-1-ynyl)silyl]methylidene]-2-propylhex-1-enyl]-dimethyl-pent-1-ynylsilane (PubChem CID 139249962) has the molecular formula C24H40Li2Si2 and a molecular weight of 398.64 g/mol. Its IUPAC name is dilithium;[3-[[dimethyl(pent-1-ynyl)silyl]methylidene]-2-propylhex-1-enyl]-dimethyl-pent-1-ynylsilane.

Molecular Properties

Compound Namedilithium;[3-[[dimethyl(pent-1-ynyl)silyl]methylidene]-2-propylhex-1-enyl]-dimethyl-pent-1-ynylsilane
PubChem CID139249962
Molecular FormulaC24H40Li2Si2
Molecular Weight398.64 g/mol
Exact Mass398.30
IUPAC Namedilithium;[3-[[dimethyl(pent-1-ynyl)silyl]methylidene]-2-propylhex-1-enyl]-dimethyl-pent-1-ynylsilane
SMILESCCCC#C[Si](C)(C)/[C-]=C(CCC)/C(=[C-]/[Si](C)(C)C#CCCC)CCC.[Li+].[Li+]
InChIInChI=1S/C24H40Si2.2Li/c1-9-13-15-19-25(5,6)21-23(17-11-3)24(18-12-4)22-26(7,8)20-16-14-10-2;;/h9-14,17-18H2,1-8H3;;/q-2;2*+1
InChIKeyDQYBZJKTECEVKW-UHFFFAOYSA-N
XLogP1.23
TPSA0.00 Ų
H-Bond Donors
H-Bond Acceptors
Rotatable Bonds9
Heavy Atoms28
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500398.64
LogP ≤ 51.23
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'}, {'alert_name': 'triple_bond', 'substructure': 'N/A'}

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Related Compounds

Dilithium;[2-hexyl-3-(trimethylsilylmethylidene)non-1-enyl]-trimethylsilane
CID 11153168
[(Z,3Z)-3-[[dimethyl(pent-1-ynyl)silyl]-iodomethylidene]-1-iodo-2-propylhex-1-enyl]-dimethyl-pent-1-ynylsilane
CID 44156047
(1,1-Dimethyl-3,4-dipropylsilol-2-yl)-dimethyl-pent-1-ynylsilane
CID 44156048
Dilithium;[2-butyl-3-(trimethylsilylmethylidene)hept-1-enyl]-trimethylsilane
CID 134888331
CID 139249964
CID 139249964
[3-Hexyl-5-[2-tri(propan-2-yl)silylethynyl]undeca-3,4-dien-1-ynyl]-tri(propan-2-yl)silane
CID 12027353
Dilithium;[2-hexyl-3-(trimethylsilylmethylidene)non-1-enyl]-trimethylsilane
CID 15973716
Trimethyl{4-[(trimethylsilyl)methylidene]dec-1-yn-1-yl}silane
CID 71415264
3,5-Dibutylnona-3,4-dien-1-ynyl-tri(propan-2-yl)silane
CID 86216613
tert-butyl-dimethyl-[(Z)-2-(3-trimethylsilylprop-2-ynyl)oct-1-enyl]silane
CID 92034767
[5-Butyl-3-[2-tri(propan-2-yl)silylethynyl]nona-3,4-dien-1-ynyl]-tri(propan-2-yl)silane
CID 101212828
trimethyl-[(4E)-4-(trimethylsilylmethylidene)dec-1-ynyl]silane
CID 101270069

Frequently Asked Questions

What is the IUPAC name of dilithium;[3-[[dimethyl(pent-1-ynyl)silyl]methylidene]-2-propylhex-1-enyl]-dimethyl-pent-1-ynylsilane?
The IUPAC name of dilithium;[3-[[dimethyl(pent-1-ynyl)silyl]methylidene]-2-propylhex-1-enyl]-dimethyl-pent-1-ynylsilane (CID 139249962) is dilithium;[3-[[dimethyl(pent-1-ynyl)silyl]methylidene]-2-propylhex-1-enyl]-dimethyl-pent-1-ynylsilane.
What is the SMILES notation for dilithium;[3-[[dimethyl(pent-1-ynyl)silyl]methylidene]-2-propylhex-1-enyl]-dimethyl-pent-1-ynylsilane?
The canonical SMILES for dilithium;[3-[[dimethyl(pent-1-ynyl)silyl]methylidene]-2-propylhex-1-enyl]-dimethyl-pent-1-ynylsilane is CCCC#C[Si](C)(C)/[C-]=C(CCC)/C(=[C-]/[Si](C)(C)C#CCCC)CCC.[Li+].[Li+].
What is the InChIKey of dilithium;[3-[[dimethyl(pent-1-ynyl)silyl]methylidene]-2-propylhex-1-enyl]-dimethyl-pent-1-ynylsilane?
The InChIKey is DQYBZJKTECEVKW-UHFFFAOYSA-N. The full InChI is InChI=1S/C24H40Si2.2Li/c1-9-13-15-19-25(5,6)21-23(17-11-3)24(18-12-4)22-26(7,8)20-16-14-10-2;;/h9-14,17-18H2,1-8H3;;/q-2;2*+1.
What are the key properties of dilithium;[3-[[dimethyl(pent-1-ynyl)silyl]methylidene]-2-propylhex-1-enyl]-dimethyl-pent-1-ynylsilane?
dilithium;[3-[[dimethyl(pent-1-ynyl)silyl]methylidene]-2-propylhex-1-enyl]-dimethyl-pent-1-ynylsilane has a molecular weight of 398.64 g/mol, XLogP of 1.23, 9 rotatable bonds, 0 hydrogen bond donors, and 0 hydrogen bond acceptors.
Where does this data come from?
All data for dilithium;[3-[[dimethyl(pent-1-ynyl)silyl]methylidene]-2-propylhex-1-enyl]-dimethyl-pent-1-ynylsilane is sourced from PubChem (CID 139249962), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).