[di(butan-2-yl)-tri(propan-2-yl)silyloxysilyl] prop-2-enoate

C20H42O3Si2 — CID 87430711

IUPAC[di(butan-2-yl)-tri(propan-2-yl)silyloxysilyl] prop-2-enoate
SMILESC=CC(=O)O[Si](O[Si](C(C)C)(C(C)C)C(C)C)(C(C)CC)C(C)CC
InChIInChI=1S/C20H42O3Si2/c1-12-18(10)25(19(11)13-2,22-20(21)14-3)23-24(15(4)5,16(6)7)17(8)9/h14-19H,3,12-13H2,1-2,4-11H3
InChIKeyBNCWCUGKODRCOI-UHFFFAOYSA-N
MW386.73 g/mol
LogP6.95
Rot. Bonds11

About [di(butan-2-yl)-tri(propan-2-yl)silyloxysilyl] prop-2-enoate

[di(butan-2-yl)-tri(propan-2-yl)silyloxysilyl] prop-2-enoate (PubChem CID 87430711) has the molecular formula C20H42O3Si2 and a molecular weight of 386.73 g/mol. Its IUPAC name is [di(butan-2-yl)-tri(propan-2-yl)silyloxysilyl] prop-2-enoate.

Molecular Properties

Compound Name[di(butan-2-yl)-tri(propan-2-yl)silyloxysilyl] prop-2-enoate
PubChem CID87430711
Molecular FormulaC20H42O3Si2
Molecular Weight386.73 g/mol
Exact Mass386.27
IUPAC Name[di(butan-2-yl)-tri(propan-2-yl)silyloxysilyl] prop-2-enoate
SMILESC=CC(=O)O[Si](O[Si](C(C)C)(C(C)C)C(C)C)(C(C)CC)C(C)CC
InChIInChI=1S/C20H42O3Si2/c1-12-18(10)25(19(11)13-2,22-20(21)14-3)23-24(15(4)5,16(6)7)17(8)9/h14-19H,3,12-13H2,1-2,4-11H3
InChIKeyBNCWCUGKODRCOI-UHFFFAOYSA-N
XLogP6.95
TPSA35.53 Ų
H-Bond Donors
H-Bond Acceptors3
Rotatable Bonds11
Heavy Atoms25
Complexity—

Lipinski Rule of Five

1 violation

RuleValue
MW ≤ 500386.73
LogP ≤ 56.95
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 103

Computed Properties (RDKit)

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

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Related Compounds

[di(butan-2-yl)-(2,3-dimethylbutan-2-yl)silyl] prop-2-enoate
CID 87879688
tri(butan-2-yl)silylmethyl prop-2-enoate
CID 141363387
[butyl-di(propan-2-yl)silyl] prop-2-enoate
CID 87900059
[octadecyl-di(propan-2-yl)silyl] prop-2-enoate
CID 87900076
CID 172734708
CID 172734708
[butan-2-yl-di(propan-2-yl)silyl] 2-methyl-3-trimethoxysilylpropanoate
CID 155659251
bis[tri(propan-2-yl)silyl] but-2-enedioate
CID 123991340
1-aminopropyl prop-2-enoate;butane
CID 87190109
[(1S)-1-hydroxypropyl] prop-2-enoate
CID 88739010
2-(1-triethoxysilylethoxy)ethyl prop-2-enoate
CID 175059321
1-tris(trimethylsilyloxy)silylbutan-2-yl prop-2-enoate
CID 18949618
1-tri(propan-2-yloxy)silylpropyl prop-2-enoate
CID 87405020

Frequently Asked Questions

What is the IUPAC name of [di(butan-2-yl)-tri(propan-2-yl)silyloxysilyl] prop-2-enoate?
The IUPAC name of [di(butan-2-yl)-tri(propan-2-yl)silyloxysilyl] prop-2-enoate (CID 87430711) is [di(butan-2-yl)-tri(propan-2-yl)silyloxysilyl] prop-2-enoate.
What is the SMILES notation for [di(butan-2-yl)-tri(propan-2-yl)silyloxysilyl] prop-2-enoate?
The canonical SMILES for [di(butan-2-yl)-tri(propan-2-yl)silyloxysilyl] prop-2-enoate is C=CC(=O)O[Si](O[Si](C(C)C)(C(C)C)C(C)C)(C(C)CC)C(C)CC.
What is the InChIKey of [di(butan-2-yl)-tri(propan-2-yl)silyloxysilyl] prop-2-enoate?
The InChIKey is BNCWCUGKODRCOI-UHFFFAOYSA-N. The full InChI is InChI=1S/C20H42O3Si2/c1-12-18(10)25(19(11)13-2,22-20(21)14-3)23-24(15(4)5,16(6)7)17(8)9/h14-19H,3,12-13H2,1-2,4-11H3.
What are the key properties of [di(butan-2-yl)-tri(propan-2-yl)silyloxysilyl] prop-2-enoate?
[di(butan-2-yl)-tri(propan-2-yl)silyloxysilyl] prop-2-enoate has a molecular weight of 386.73 g/mol, XLogP of 6.95, 11 rotatable bonds, 0 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for [di(butan-2-yl)-tri(propan-2-yl)silyloxysilyl] prop-2-enoate is sourced from PubChem (CID 87430711), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).