1-[3-[[methoxy(dimethyl)silyl]oxy-dimethylsilyl]propoxy]but-3-en-2-one

C12H26O4Si2 — CID 140777508

IUPAC1-[3-[[methoxy(dimethyl)silyl]oxy-dimethylsilyl]propoxy]but-3-en-2-one
SMILESC=CC(=O)COCCC[Si](C)(C)O[Si](C)(C)OC
InChIInChI=1S/C12H26O4Si2/c1-7-12(13)11-15-9-8-10-17(3,4)16-18(5,6)14-2/h7H,1,8-11H2,2-6H3
InChIKeyLNDMMVBJWGKSNF-UHFFFAOYSA-N
MW290.51 g/mol
LogP2.72
Rot. Bonds10

About 1-[3-[[methoxy(dimethyl)silyl]oxy-dimethylsilyl]propoxy]but-3-en-2-one

1-[3-[[methoxy(dimethyl)silyl]oxy-dimethylsilyl]propoxy]but-3-en-2-one (PubChem CID 140777508) has the molecular formula C12H26O4Si2 and a molecular weight of 290.51 g/mol. Its IUPAC name is 1-[3-[[methoxy(dimethyl)silyl]oxy-dimethylsilyl]propoxy]but-3-en-2-one.

Molecular Properties

Compound Name1-[3-[[methoxy(dimethyl)silyl]oxy-dimethylsilyl]propoxy]but-3-en-2-one
PubChem CID140777508
Molecular FormulaC12H26O4Si2
Molecular Weight290.51 g/mol
Exact Mass290.14
IUPAC Name1-[3-[[methoxy(dimethyl)silyl]oxy-dimethylsilyl]propoxy]but-3-en-2-one
SMILESC=CC(=O)COCCC[Si](C)(C)O[Si](C)(C)OC
InChIInChI=1S/C12H26O4Si2/c1-7-12(13)11-15-9-8-10-17(3,4)16-18(5,6)14-2/h7H,1,8-11H2,2-6H3
InChIKeyLNDMMVBJWGKSNF-UHFFFAOYSA-N
XLogP2.72
TPSA44.76 Ų
H-Bond Donors
H-Bond Acceptors4
Rotatable Bonds10
Heavy Atoms18
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500290.51
LogP ≤ 52.72
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 104

Computed Properties (RDKit)

Structural Alerts{'alert_name': 'Aliphatic_long_chain', 'substructure': 'N/A'}, {'alert_name': 'heavy_metal', 'substructure': 'N/A'}, {'alert_name': 'Michael_acceptor_1', 'substructure': 'N/A'}

Analyze 1-[3-[[methoxy(dimethyl)silyl]oxy-dimethylsilyl]propoxy]but-3-en-2-one 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

1-[4-[[methoxy(dimethyl)silyl]oxy-dimethylsilyl]butoxy]but-3-en-2-one
CID 140777511
3-[[[methoxy(dimethyl)silyl]oxy-dimethylsilyl]oxy-dimethylsilyl]propyl prop-2-enoate
CID 150144614
4-[methoxy(dimethyl)silyl]butyl 2-methylprop-2-enoate;4-[methoxy(dimethyl)silyl]butyl prop-2-enoate;1-[4-[[methoxy(dimethyl)silyl]oxy-dimethylsilyl]butoxy]but-3-en-2-one;1-[4-[[methoxy(dimethyl)silyl]oxy-dimethylsilyl]butoxy]-3-methylbut-3-en-2-one;1-[3-[[methoxy(dimethyl)silyl]oxy-dimethylsilyl]propoxy]but-3-en-2-one;1-[3-[[methoxy(dimethyl)silyl]oxy-dimethylsilyl]propoxy]-3-methylbut-3-en-2-one;3-[[methoxy(dimethyl)silyl]oxy-dimethylsilyl]propyl 2-methylprop-2-enoate;3-[[methoxy(dimethyl)silyl]oxy-dimethylsilyl]propyl prop-2-enoate;5-[methoxy(dimethyl)silyl]pentyl 2-methylprop-2-enoate;5-[methoxy(dimethyl)silyl]pentyl prop-2-enoate;3-[methoxy(dimethyl)silyl]propyl 2-methylprop-2-enoate;3-[methoxy(dimethyl)silyl]propyl prop-2-enoate
CID 161047709
6-(2-oxobut-3-enoxy)hex-1-en-3-one
CID 147998253
3-[dimethyl(trimethoxysilyloxy)silyl]propyl prop-2-enoate
CID 22726207
6-[[[dimethyl(6-prop-2-enoyloxyhexyl)silyl]oxy-dimethylsilyl]oxy-dimethylsilyl]hexyl prop-2-enoate
CID 89309257
2-[3-[[[butyl(dimethyl)silyl]oxy-dimethylsilyl]oxy-dimethylsilyl]propoxy]ethyl ethenyl carbonate
CID 58104910
4-[[[[[[[[[[[[[[[[[[[[[[[[[4-ethenoxycarbonyloxybutyl(dimethyl)silyl]oxy-dimethylsilyl]oxy-dimethylsilyl]oxy-dimethylsilyl]oxy-dimethylsilyl]oxy-dimethylsilyl]oxy-dimethylsilyl]oxy-dimethylsilyl]oxy-dimethylsilyl]oxy-dimethylsilyl]oxy-dimethylsilyl]oxy-dimethylsilyl]oxy-dimethylsilyl]oxy-dimethylsilyl]oxy-dimethylsilyl]oxy-dimethylsilyl]oxy-dimethylsilyl]oxy-dimethylsilyl]oxy-dimethylsilyl]oxy-dimethylsilyl]oxy-dimethylsilyl]oxy-dimethylsilyl]oxy-dimethylsilyl]oxy-dimethylsilyl]oxy-dimethylsilyl]butyl ethenyl carbonate
CID 91076405
3-(2-methoxyethoxy)propyl-[3-(2-methoxyethoxy)propyl-dimethylsilyl]oxy-dimethylsilane
CID 58607575
7-[3-[[[[[butyl(dimethyl)silyl]oxy-dimethylsilyl]oxy-dimethylsilyl]oxy-dimethylsilyl]oxy-dimethylsilyl]propoxy]-6-hydroxyhept-1-en-3-one;N-[3-[3-[[[[[butyl(dimethyl)silyl]oxy-dimethylsilyl]oxy-dimethylsilyl]oxy-dimethylsilyl]oxy-dimethylsilyl]propoxy]-2-hydroxypropyl]-N-methylprop-2-enamide
CID 160758382
3-[[[dimethyl-[3-[2-(2-methylprop-2-enoyloxy)ethoxy]propyl]silyl]oxy-dimethylsilyl]oxy-dimethylsilyl]propyl 2-methylprop-2-enoate
CID 164811987
[2-hydroxy-3-[3-[methoxy(dimethyl)silyl]propoxy]propyl] prop-2-enoate;methane
CID 158252465

Frequently Asked Questions

What is the IUPAC name of 1-[3-[[methoxy(dimethyl)silyl]oxy-dimethylsilyl]propoxy]but-3-en-2-one?
The IUPAC name of 1-[3-[[methoxy(dimethyl)silyl]oxy-dimethylsilyl]propoxy]but-3-en-2-one (CID 140777508) is 1-[3-[[methoxy(dimethyl)silyl]oxy-dimethylsilyl]propoxy]but-3-en-2-one.
What is the SMILES notation for 1-[3-[[methoxy(dimethyl)silyl]oxy-dimethylsilyl]propoxy]but-3-en-2-one?
The canonical SMILES for 1-[3-[[methoxy(dimethyl)silyl]oxy-dimethylsilyl]propoxy]but-3-en-2-one is C=CC(=O)COCCC[Si](C)(C)O[Si](C)(C)OC.
What is the InChIKey of 1-[3-[[methoxy(dimethyl)silyl]oxy-dimethylsilyl]propoxy]but-3-en-2-one?
The InChIKey is LNDMMVBJWGKSNF-UHFFFAOYSA-N. The full InChI is InChI=1S/C12H26O4Si2/c1-7-12(13)11-15-9-8-10-17(3,4)16-18(5,6)14-2/h7H,1,8-11H2,2-6H3.
What are the key properties of 1-[3-[[methoxy(dimethyl)silyl]oxy-dimethylsilyl]propoxy]but-3-en-2-one?
1-[3-[[methoxy(dimethyl)silyl]oxy-dimethylsilyl]propoxy]but-3-en-2-one has a molecular weight of 290.51 g/mol, XLogP of 2.72, 10 rotatable bonds, 0 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 1-[3-[[methoxy(dimethyl)silyl]oxy-dimethylsilyl]propoxy]but-3-en-2-one is sourced from PubChem (CID 140777508), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).