4,4-bis[[dimethyl(2-methylpropyl)silyl]oxy]pent-1-ynyl-trimethylsilane

C20H44O2Si3 — CID 144689663

IUPAC4,4-bis[[dimethyl(2-methylpropyl)silyl]oxy]pent-1-ynyl-trimethylsilane
SMILESCC(C)C[Si](C)(C)OC(C)(CC#C[Si](C)(C)C)O[Si](C)(C)CC(C)C
InChIInChI=1S/C20H44O2Si3/c1-18(2)16-24(9,10)21-20(5,14-13-15-23(6,7)8)22-25(11,12)17-19(3)4/h18-19H,14,16-17H2,1-12H3
InChIKeySURYSPODSOVRNA-UHFFFAOYSA-N
MW400.83 g/mol
LogP6.73
Rot. Bonds9

About 4,4-bis[[dimethyl(2-methylpropyl)silyl]oxy]pent-1-ynyl-trimethylsilane

4,4-bis[[dimethyl(2-methylpropyl)silyl]oxy]pent-1-ynyl-trimethylsilane (PubChem CID 144689663) has the molecular formula C20H44O2Si3 and a molecular weight of 400.83 g/mol. Its IUPAC name is 4,4-bis[[dimethyl(2-methylpropyl)silyl]oxy]pent-1-ynyl-trimethylsilane.

Molecular Properties

Compound Name4,4-bis[[dimethyl(2-methylpropyl)silyl]oxy]pent-1-ynyl-trimethylsilane
PubChem CID144689663
Molecular FormulaC20H44O2Si3
Molecular Weight400.83 g/mol
Exact Mass400.26
IUPAC Name4,4-bis[[dimethyl(2-methylpropyl)silyl]oxy]pent-1-ynyl-trimethylsilane
SMILESCC(C)C[Si](C)(C)OC(C)(CC#C[Si](C)(C)C)O[Si](C)(C)CC(C)C
InChIInChI=1S/C20H44O2Si3/c1-18(2)16-24(9,10)21-20(5,14-13-15-23(6,7)8)22-25(11,12)17-19(3)4/h18-19H,14,16-17H2,1-12H3
InChIKeySURYSPODSOVRNA-UHFFFAOYSA-N
XLogP6.73
TPSA18.46 Ų
H-Bond Donors
H-Bond Acceptors2
Rotatable Bonds9
Heavy Atoms25
Complexity—

Lipinski Rule of Five

1 violation

RuleValue
MW ≤ 500400.83
LogP ≤ 56.73
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 102

Computed Properties (RDKit)

Structural Alerts{'alert_name': 'heavy_metal', 'substructure': 'N/A'}, {'alert_name': 'het-C-het_not_in_ring', 'substructure': 'N/A'}, {'alert_name': 'triple_bond', 'substructure': 'N/A'}

Analyze 4,4-bis[[dimethyl(2-methylpropyl)silyl]oxy]pent-1-ynyl-trimethylsilane with MolForge

Explore ADMET properties, 3D molecular structure, drug-likeness score, and discover similar compounds using our AI-powered platform.

Launch Full Analysis

Related Compounds

tert-butyl-dimethyl-[(2S)-2-methyl-4-tri(propan-2-yl)silyloxybut-3-ynoxy]silane
CID 134873799
Tert-butyl-[9-[tert-butyl(dimethyl)silyl]oxydeca-4,6-diyn-2-yloxy]-dimethylsilane
CID 134977101
Trimethyl-[2-[tris(2-methylbut-3-yn-2-yloxy)silyl]ethyl]silane
CID 54445108
Trimethyl-[1-[tris(2-methylbut-3-yn-2-yloxy)silyl]ethyl]silane
CID 57075904
Dimethyl-bis(2-methylbut-3-yn-2-yloxy)silane;[ethyl(oxo)silyl]methyl-dimethyl-[methyl-(2-methylbut-3-yn-2-yloxy)-trimethylsilyloxysilyl]oxysilane
CID 164079586
Tert-butyl-[2-[tert-butyl(methyl)silyl]oxy-4-ethoxybut-3-yn-2-yl]oxy-methylsilane
CID 173401418
Trimethyl-[2-trimethylsilyloxy-4-(1-trimethylsilyloxycyclopropyl)but-3-yn-2-yl]silane
CID 10545283
tert-butyl-dimethyl-[(2R)-2-methyl-4-tri(propan-2-yl)silyloxybut-3-ynoxy]silane
CID 10959633
tert-butyl-[(2S,11S)-11-[tert-butyl(dimethyl)silyl]oxydodeca-3,5,7,9-tetrayn-2-yl]oxy-dimethylsilane
CID 11223738
Tert-butyl-[5-[tert-butyl(dimethyl)silyl]oxyhex-3-yn-2-yloxy]-dimethylsilane
CID 16007374
[2,9-Dimethyl-9-tri(propan-2-yl)silyloxydeca-3,5,7-triyn-2-yl]oxy-tri(propan-2-yl)silane
CID 101034705

Frequently Asked Questions

What is the IUPAC name of 4,4-bis[[dimethyl(2-methylpropyl)silyl]oxy]pent-1-ynyl-trimethylsilane?
The IUPAC name of 4,4-bis[[dimethyl(2-methylpropyl)silyl]oxy]pent-1-ynyl-trimethylsilane (CID 144689663) is 4,4-bis[[dimethyl(2-methylpropyl)silyl]oxy]pent-1-ynyl-trimethylsilane.
What is the SMILES notation for 4,4-bis[[dimethyl(2-methylpropyl)silyl]oxy]pent-1-ynyl-trimethylsilane?
The canonical SMILES for 4,4-bis[[dimethyl(2-methylpropyl)silyl]oxy]pent-1-ynyl-trimethylsilane is CC(C)C[Si](C)(C)OC(C)(CC#C[Si](C)(C)C)O[Si](C)(C)CC(C)C.
What is the InChIKey of 4,4-bis[[dimethyl(2-methylpropyl)silyl]oxy]pent-1-ynyl-trimethylsilane?
The InChIKey is SURYSPODSOVRNA-UHFFFAOYSA-N. The full InChI is InChI=1S/C20H44O2Si3/c1-18(2)16-24(9,10)21-20(5,14-13-15-23(6,7)8)22-25(11,12)17-19(3)4/h18-19H,14,16-17H2,1-12H3.
What are the key properties of 4,4-bis[[dimethyl(2-methylpropyl)silyl]oxy]pent-1-ynyl-trimethylsilane?
4,4-bis[[dimethyl(2-methylpropyl)silyl]oxy]pent-1-ynyl-trimethylsilane has a molecular weight of 400.83 g/mol, XLogP of 6.73, 9 rotatable bonds, 0 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 4,4-bis[[dimethyl(2-methylpropyl)silyl]oxy]pent-1-ynyl-trimethylsilane is sourced from PubChem (CID 144689663), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).