1,2,2,3,3,4,4-heptafluorobutoxy(trimethyl)silane

C7H11F7OSi — CID 18970464

IUPAC1,2,2,3,3,4,4-heptafluorobutoxy(trimethyl)silane
SMILESC[Si](C)(C)OC(F)C(F)(F)C(F)(F)C(F)F
InChIInChI=1S/C7H11F7OSi/c1-16(2,3)15-5(10)7(13,14)6(11,12)4(8)9/h4-5H,1-3H3
InChIKeyJWOMWJVFQUAQHM-UHFFFAOYSA-N
MW272.24 g/mol
LogP3.67
Rot. Bonds5

About 1,2,2,3,3,4,4-heptafluorobutoxy(trimethyl)silane

1,2,2,3,3,4,4-heptafluorobutoxy(trimethyl)silane (PubChem CID 18970464) has the molecular formula C7H11F7OSi and a molecular weight of 272.24 g/mol. Its IUPAC name is 1,2,2,3,3,4,4-heptafluorobutoxy(trimethyl)silane.

Molecular Properties

Compound Name1,2,2,3,3,4,4-heptafluorobutoxy(trimethyl)silane
PubChem CID18970464
Molecular FormulaC7H11F7OSi
Molecular Weight272.24 g/mol
Exact Mass272.05
IUPAC Name1,2,2,3,3,4,4-heptafluorobutoxy(trimethyl)silane
SMILESC[Si](C)(C)OC(F)C(F)(F)C(F)(F)C(F)F
InChIInChI=1S/C7H11F7OSi/c1-16(2,3)15-5(10)7(13,14)6(11,12)4(8)9/h4-5H,1-3H3
InChIKeyJWOMWJVFQUAQHM-UHFFFAOYSA-N
XLogP3.67
TPSA9.23 Ų
H-Bond Donors
H-Bond Acceptors1
Rotatable Bonds5
Heavy Atoms16
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500272.24
LogP ≤ 53.67
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 101

Computed Properties (RDKit)

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

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Related Compounds

Trimethyl(2,2,2-trifluoroethoxy)silane
CID 10953986
Ethoxydimethyl (3,3,4,4,4-pentafluorobutyl) silane
CID 59112324
Ethoxydimethyl (3,3,4,4,5,5,5-heptafluoropentyl) silane
CID 59112366
[(1,1,1,3,3,3-Hexafluoropropan-2-yl)oxy](trimethyl)silane
CID 272694
2,2-Difluoroethanol trimethylsilyl ether
CID 91691655
Silane, dimethyldi(2,2,3,3,4,4,5,5-octafluoropentyloxy)-
CID 13583182
(2,2,3,3-Tetrafluoropropoxy)trimethylsilane
CID 12711277
(2,2,3,3,4,4,5,5-Octafluoropentoxy)trimethylsilane
CID 12711278
Trimethyl(2,2,3,3,3-pentafluoropropoxy)silane
CID 13179201
Dimethyl-bis(2,2,2-trifluoroethoxy)silane
CID 20670407
Chloro-dimethyl-(2,2,3,3-tetrafluoropropoxy)silane
CID 14197918
[Dimethyl(2,2,3,3-tetrafluoropropoxy)silyl]formonitrile
CID 14874586

Frequently Asked Questions

What is the IUPAC name of 1,2,2,3,3,4,4-heptafluorobutoxy(trimethyl)silane?
The IUPAC name of 1,2,2,3,3,4,4-heptafluorobutoxy(trimethyl)silane (CID 18970464) is 1,2,2,3,3,4,4-heptafluorobutoxy(trimethyl)silane.
What is the SMILES notation for 1,2,2,3,3,4,4-heptafluorobutoxy(trimethyl)silane?
The canonical SMILES for 1,2,2,3,3,4,4-heptafluorobutoxy(trimethyl)silane is C[Si](C)(C)OC(F)C(F)(F)C(F)(F)C(F)F.
What is the InChIKey of 1,2,2,3,3,4,4-heptafluorobutoxy(trimethyl)silane?
The InChIKey is JWOMWJVFQUAQHM-UHFFFAOYSA-N. The full InChI is InChI=1S/C7H11F7OSi/c1-16(2,3)15-5(10)7(13,14)6(11,12)4(8)9/h4-5H,1-3H3.
What are the key properties of 1,2,2,3,3,4,4-heptafluorobutoxy(trimethyl)silane?
1,2,2,3,3,4,4-heptafluorobutoxy(trimethyl)silane has a molecular weight of 272.24 g/mol, XLogP of 3.67, 5 rotatable bonds, 0 hydrogen bond donors, and 1 hydrogen bond acceptors.
Where does this data come from?
All data for 1,2,2,3,3,4,4-heptafluorobutoxy(trimethyl)silane is sourced from PubChem (CID 18970464), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).