[1-(4-fluorophenyl)-3-methylbut-2-en-2-yl]-trimethylsilane

C14H21FSi — CID 10776227

IUPAC[1-(4-fluorophenyl)-3-methylbut-2-en-2-yl]-trimethylsilane
SMILESCC(C)=C(Cc1ccc(F)cc1)[Si](C)(C)C
InChIInChI=1S/C14H21FSi/c1-11(2)14(16(3,4)5)10-12-6-8-13(15)9-7-12/h6-9H,10H2,1-5H3
InChIKeyAMVULNMTTCTQFM-UHFFFAOYSA-N
MW236.41 g/mol
LogP4.58
Rot. Bonds3

About [1-(4-fluorophenyl)-3-methylbut-2-en-2-yl]-trimethylsilane

[1-(4-fluorophenyl)-3-methylbut-2-en-2-yl]-trimethylsilane (PubChem CID 10776227) has the molecular formula C14H21FSi and a molecular weight of 236.41 g/mol. Its IUPAC name is [1-(4-fluorophenyl)-3-methylbut-2-en-2-yl]-trimethylsilane.

Molecular Properties

Compound Name[1-(4-fluorophenyl)-3-methylbut-2-en-2-yl]-trimethylsilane
PubChem CID10776227
Molecular FormulaC14H21FSi
Molecular Weight236.41 g/mol
Exact Mass236.14
IUPAC Name[1-(4-fluorophenyl)-3-methylbut-2-en-2-yl]-trimethylsilane
SMILESCC(C)=C(Cc1ccc(F)cc1)[Si](C)(C)C
InChIInChI=1S/C14H21FSi/c1-11(2)14(16(3,4)5)10-12-6-8-13(15)9-7-12/h6-9H,10H2,1-5H3
InChIKeyAMVULNMTTCTQFM-UHFFFAOYSA-N
XLogP4.58
TPSA0.00 Ų
H-Bond Donors
H-Bond Acceptors
Rotatable Bonds3
Heavy Atoms16
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500236.41
LogP ≤ 54.58
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 100

Computed Properties (RDKit)

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

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Related Compounds

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1,3-bis(4-fluorophenyl)propan-2-ylidenezirconium(2+)
CID 87754590
1-(4-fluorophenyl)pentane-2,4-dione
CID 57447744
1-fluoro-4-(2-methylidenebutyl)benzene
CID 91243133
(Z)-5-(4-fluorophenyl)-4-methylpent-3-en-2-ol
CID 114835346
3-(4-fluorophenyl)prop-1-ene-1,1,2-tricarbonitrile
CID 131858572
1-(4-fluorophenyl)-3-pyridin-4-ylpropan-2-one
CID 62551750
2-[(4-fluorophenyl)methyl]prop-2-en-1-ol
CID 117266723
(4-fluorophenyl)methoxy-trimethylsilane
CID 573272
N-(4-fluorophenyl)-2-(4-methylphenyl)acetamide
CID 889367

Frequently Asked Questions

What is the IUPAC name of [1-(4-fluorophenyl)-3-methylbut-2-en-2-yl]-trimethylsilane?
The IUPAC name of [1-(4-fluorophenyl)-3-methylbut-2-en-2-yl]-trimethylsilane (CID 10776227) is [1-(4-fluorophenyl)-3-methylbut-2-en-2-yl]-trimethylsilane.
What is the SMILES notation for [1-(4-fluorophenyl)-3-methylbut-2-en-2-yl]-trimethylsilane?
The canonical SMILES for [1-(4-fluorophenyl)-3-methylbut-2-en-2-yl]-trimethylsilane is CC(C)=C(Cc1ccc(F)cc1)[Si](C)(C)C.
What is the InChIKey of [1-(4-fluorophenyl)-3-methylbut-2-en-2-yl]-trimethylsilane?
The InChIKey is AMVULNMTTCTQFM-UHFFFAOYSA-N. The full InChI is InChI=1S/C14H21FSi/c1-11(2)14(16(3,4)5)10-12-6-8-13(15)9-7-12/h6-9H,10H2,1-5H3.
What are the key properties of [1-(4-fluorophenyl)-3-methylbut-2-en-2-yl]-trimethylsilane?
[1-(4-fluorophenyl)-3-methylbut-2-en-2-yl]-trimethylsilane has a molecular weight of 236.41 g/mol, XLogP of 4.58, 3 rotatable bonds, 0 hydrogen bond donors, and 0 hydrogen bond acceptors.
Where does this data come from?
All data for [1-(4-fluorophenyl)-3-methylbut-2-en-2-yl]-trimethylsilane is sourced from PubChem (CID 10776227), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).