(2,6-difluoro-4-pentylphenyl)-trimethylsilane

C14H22F2Si — CID 15751979

IUPAC(2,6-difluoro-4-pentylphenyl)-trimethylsilane
SMILESCCCCCc1cc(F)c([Si](C)(C)C)c(F)c1
InChIInChI=1S/C14H22F2Si/c1-5-6-7-8-11-9-12(15)14(13(16)10-11)17(2,3)4/h9-10H,5-8H2,1-4H3
InChIKeyMFHBDTHKNMXXBD-UHFFFAOYSA-N
MW256.41 g/mol
LogP4.24
Rot. Bonds5

About (2,6-difluoro-4-pentylphenyl)-trimethylsilane

(2,6-difluoro-4-pentylphenyl)-trimethylsilane (PubChem CID 15751979) has the molecular formula C14H22F2Si and a molecular weight of 256.41 g/mol. Its IUPAC name is (2,6-difluoro-4-pentylphenyl)-trimethylsilane.

Molecular Properties

Compound Name(2,6-difluoro-4-pentylphenyl)-trimethylsilane
PubChem CID15751979
Molecular FormulaC14H22F2Si
Molecular Weight256.41 g/mol
Exact Mass256.15
IUPAC Name(2,6-difluoro-4-pentylphenyl)-trimethylsilane
SMILESCCCCCc1cc(F)c([Si](C)(C)C)c(F)c1
InChIInChI=1S/C14H22F2Si/c1-5-6-7-8-11-9-12(15)14(13(16)10-11)17(2,3)4/h9-10H,5-8H2,1-4H3
InChIKeyMFHBDTHKNMXXBD-UHFFFAOYSA-N
XLogP4.24
TPSA0.00 Ų
H-Bond Donors
H-Bond Acceptors
Rotatable Bonds5
Heavy Atoms17
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500256.41
LogP ≤ 54.24
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 100

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

1,3-difluoro-2,5-dipentylbenzene
CID 138738043
(3,5-dioctylphenyl)-trimethylsilane
CID 156630407
2-(difluoromethyl)-1,3-difluoro-5-heptylbenzene
CID 20653964
1-butyl-3,5-di(tetradecyl)benzene
CID 91192270
2-fluoro-4-pentylaniline
CID 146198864
(2-ethenyl-4,6-dihexylphenyl)-trimethylsilane
CID 11325397
1-ethyl-3,5-di(tetradecyl)benzene
CID 91801932
1,3-didecyl-5-(3,5-didecylphenyl)benzene
CID 150677432
(2-fluoro-4-pentylphenyl)boronic acid
CID 54278063
5-hexylbenzene-1,2,3-triol
CID 54026211
2-(2,6-difluoro-4-pentylphenyl)-5-ethyl-1,3,2-dioxaborinane
CID 67648574
5-(2,6-difluoro-4-pentylphenyl)-2-(3,5-difluorophenyl)pyrimidine
CID 19380596

Frequently Asked Questions

What is the IUPAC name of (2,6-difluoro-4-pentylphenyl)-trimethylsilane?
The IUPAC name of (2,6-difluoro-4-pentylphenyl)-trimethylsilane (CID 15751979) is (2,6-difluoro-4-pentylphenyl)-trimethylsilane.
What is the SMILES notation for (2,6-difluoro-4-pentylphenyl)-trimethylsilane?
The canonical SMILES for (2,6-difluoro-4-pentylphenyl)-trimethylsilane is CCCCCc1cc(F)c([Si](C)(C)C)c(F)c1.
What is the InChIKey of (2,6-difluoro-4-pentylphenyl)-trimethylsilane?
The InChIKey is MFHBDTHKNMXXBD-UHFFFAOYSA-N. The full InChI is InChI=1S/C14H22F2Si/c1-5-6-7-8-11-9-12(15)14(13(16)10-11)17(2,3)4/h9-10H,5-8H2,1-4H3.
What are the key properties of (2,6-difluoro-4-pentylphenyl)-trimethylsilane?
(2,6-difluoro-4-pentylphenyl)-trimethylsilane has a molecular weight of 256.41 g/mol, XLogP of 4.24, 5 rotatable bonds, 0 hydrogen bond donors, and 0 hydrogen bond acceptors.
Where does this data come from?
All data for (2,6-difluoro-4-pentylphenyl)-trimethylsilane is sourced from PubChem (CID 15751979), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).