2-trimethylsilylethyl [hexyl(dimethyl)silyl]formate

C14H32O2Si2 — CID 87902808

IUPAC2-trimethylsilylethyl [hexyl(dimethyl)silyl]formate
SMILESCCCCCC[Si](C)(C)C(=O)OCC[Si](C)(C)C
InChIInChI=1S/C14H32O2Si2/c1-7-8-9-10-12-18(5,6)14(15)16-11-13-17(2,3)4/h7-13H2,1-6H3
InChIKeyLQMQVMMANOETDM-UHFFFAOYSA-N
MW288.58 g/mol
LogP5.33
Rot. Bonds9

About 2-trimethylsilylethyl [hexyl(dimethyl)silyl]formate

2-trimethylsilylethyl [hexyl(dimethyl)silyl]formate (PubChem CID 87902808) has the molecular formula C14H32O2Si2 and a molecular weight of 288.58 g/mol. Its IUPAC name is 2-trimethylsilylethyl [hexyl(dimethyl)silyl]formate.

Molecular Properties

Compound Name2-trimethylsilylethyl [hexyl(dimethyl)silyl]formate
PubChem CID87902808
Molecular FormulaC14H32O2Si2
Molecular Weight288.58 g/mol
Exact Mass288.19
IUPAC Name2-trimethylsilylethyl [hexyl(dimethyl)silyl]formate
SMILESCCCCCC[Si](C)(C)C(=O)OCC[Si](C)(C)C
InChIInChI=1S/C14H32O2Si2/c1-7-8-9-10-12-18(5,6)14(15)16-11-13-17(2,3)4/h7-13H2,1-6H3
InChIKeyLQMQVMMANOETDM-UHFFFAOYSA-N
XLogP5.33
TPSA26.30 Ų
H-Bond Donors
H-Bond Acceptors2
Rotatable Bonds9
Heavy Atoms18
Complexity—

Lipinski Rule of Five

1 violation

RuleValue
MW ≤ 500288.58
LogP ≤ 55.33
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 102

Computed Properties (RDKit)

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

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Related Compounds

octyl 2-trimethylsilylethyl carbonate
CID 172701355
2-trimethylsilylethyl heptanoate
CID 141105261
2-trimethylsilylethyl N-butylcarbamate
CID 102394632
(2S)-2-(2-trimethylsilylethoxycarbonylamino)octanoic acid
CID 162340818
2-trimethylsilylethyl N-[(Z)-4-oxotridec-2-en-3-yl]carbamate
CID 140870286
methane;trimethyl(pentyl)silane
CID 161366359
2-oxo-2-(2-trimethylsilylethoxy)acetic acid
CID 54505064
hexoxycarbonyl hexyl carbonate
CID 18974231
diethyl 2-(12-trimethylsilyldodecyl)propanedioate
CID 86200825
7-[dimethyl(octadecyl)silyl]heptanamide
CID 175975637
ditridecyl oxalate
CID 18377796
dioctyl carbonate
CID 174882674

Frequently Asked Questions

What is the IUPAC name of 2-trimethylsilylethyl [hexyl(dimethyl)silyl]formate?
The IUPAC name of 2-trimethylsilylethyl [hexyl(dimethyl)silyl]formate (CID 87902808) is 2-trimethylsilylethyl [hexyl(dimethyl)silyl]formate.
What is the SMILES notation for 2-trimethylsilylethyl [hexyl(dimethyl)silyl]formate?
The canonical SMILES for 2-trimethylsilylethyl [hexyl(dimethyl)silyl]formate is CCCCCC[Si](C)(C)C(=O)OCC[Si](C)(C)C.
What is the InChIKey of 2-trimethylsilylethyl [hexyl(dimethyl)silyl]formate?
The InChIKey is LQMQVMMANOETDM-UHFFFAOYSA-N. The full InChI is InChI=1S/C14H32O2Si2/c1-7-8-9-10-12-18(5,6)14(15)16-11-13-17(2,3)4/h7-13H2,1-6H3.
What are the key properties of 2-trimethylsilylethyl [hexyl(dimethyl)silyl]formate?
2-trimethylsilylethyl [hexyl(dimethyl)silyl]formate has a molecular weight of 288.58 g/mol, XLogP of 5.33, 9 rotatable bonds, 0 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 2-trimethylsilylethyl [hexyl(dimethyl)silyl]formate is sourced from PubChem (CID 87902808), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).