5-[dimethyl-[2-tris(ethenyl)silylethyl]silyl]pentan-2-yl hydrogen carbonate

C16H30O3Si2 — CID 175000083

IUPAC5-[dimethyl-[2-tris(ethenyl)silylethyl]silyl]pentan-2-yl hydrogen carbonate
SMILESC=C[Si](C=C)(C=C)CC[Si](C)(C)CCCC(C)OC(=O)O
InChIInChI=1S/C16H30O3Si2/c1-7-21(8-2,9-3)14-13-20(5,6)12-10-11-15(4)19-16(17)18/h7-9,15H,1-3,10-14H2,4-6H3,(H,17,18)
InChIKeyUBZTXYWEDYQKSD-UHFFFAOYSA-N
MW326.59 g/mol
LogP5.18
Rot. Bonds11

About 5-[dimethyl-[2-tris(ethenyl)silylethyl]silyl]pentan-2-yl hydrogen carbonate

5-[dimethyl-[2-tris(ethenyl)silylethyl]silyl]pentan-2-yl hydrogen carbonate (PubChem CID 175000083) has the molecular formula C16H30O3Si2 and a molecular weight of 326.59 g/mol. Its IUPAC name is 5-[dimethyl-[2-tris(ethenyl)silylethyl]silyl]pentan-2-yl hydrogen carbonate.

Molecular Properties

Compound Name5-[dimethyl-[2-tris(ethenyl)silylethyl]silyl]pentan-2-yl hydrogen carbonate
PubChem CID175000083
Molecular FormulaC16H30O3Si2
Molecular Weight326.59 g/mol
Exact Mass326.17
IUPAC Name5-[dimethyl-[2-tris(ethenyl)silylethyl]silyl]pentan-2-yl hydrogen carbonate
SMILESC=C[Si](C=C)(C=C)CC[Si](C)(C)CCCC(C)OC(=O)O
InChIInChI=1S/C16H30O3Si2/c1-7-21(8-2,9-3)14-13-20(5,6)12-10-11-15(4)19-16(17)18/h7-9,15H,1-3,10-14H2,4-6H3,(H,17,18)
InChIKeyUBZTXYWEDYQKSD-UHFFFAOYSA-N
XLogP5.18
TPSA46.53 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds11
Heavy Atoms21
Complexity—

Lipinski Rule of Five

1 violation

RuleValue
MW ≤ 500326.59
LogP ≤ 55.18
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

Computed Properties (RDKit)

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

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Related Compounds

5-[but-2-en-2-ylsilylmethyl(dimethyl)silyl]pentan-2-yl hydrogen carbonate
CID 175003079
heptadecan-2-yl hydrogen carbonate
CID 87300493
5-[diethoxy(methyl)silyl]pentan-2-yl prop-2-enoate
CID 141250825
5-trihydroxysilylpentan-2-yl acetate
CID 90797840
9-trihydroxysilylnonan-2-yl prop-2-enoate
CID 176894316
6-prop-2-enoyloxyheptan-2-yl prop-2-enoate
CID 58537732
21-[chloro(dimethyl)silyl]henicosan-2-yl prop-2-enoate
CID 168864206
19-[iodo(dimethyl)silyl]nonadecan-2-yl prop-2-enoate
CID 168864259
20-[iodo(dimethyl)silyl]icosan-2-yl prop-2-enoate
CID 168864209
6-triiodosilylhexan-2-yl prop-2-enoate
CID 168864108
15-triiodosilylpentadecan-2-yl prop-2-enoate
CID 168864274
4-carboxyoxypentan-2-yl hydrogen carbonate
CID 87735224

Frequently Asked Questions

What is the IUPAC name of 5-[dimethyl-[2-tris(ethenyl)silylethyl]silyl]pentan-2-yl hydrogen carbonate?
The IUPAC name of 5-[dimethyl-[2-tris(ethenyl)silylethyl]silyl]pentan-2-yl hydrogen carbonate (CID 175000083) is 5-[dimethyl-[2-tris(ethenyl)silylethyl]silyl]pentan-2-yl hydrogen carbonate.
What is the SMILES notation for 5-[dimethyl-[2-tris(ethenyl)silylethyl]silyl]pentan-2-yl hydrogen carbonate?
The canonical SMILES for 5-[dimethyl-[2-tris(ethenyl)silylethyl]silyl]pentan-2-yl hydrogen carbonate is C=C[Si](C=C)(C=C)CC[Si](C)(C)CCCC(C)OC(=O)O.
What is the InChIKey of 5-[dimethyl-[2-tris(ethenyl)silylethyl]silyl]pentan-2-yl hydrogen carbonate?
The InChIKey is UBZTXYWEDYQKSD-UHFFFAOYSA-N. The full InChI is InChI=1S/C16H30O3Si2/c1-7-21(8-2,9-3)14-13-20(5,6)12-10-11-15(4)19-16(17)18/h7-9,15H,1-3,10-14H2,4-6H3,(H,17,18).
What are the key properties of 5-[dimethyl-[2-tris(ethenyl)silylethyl]silyl]pentan-2-yl hydrogen carbonate?
5-[dimethyl-[2-tris(ethenyl)silylethyl]silyl]pentan-2-yl hydrogen carbonate has a molecular weight of 326.59 g/mol, XLogP of 5.18, 11 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 5-[dimethyl-[2-tris(ethenyl)silylethyl]silyl]pentan-2-yl hydrogen carbonate is sourced from PubChem (CID 175000083), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).