[4-chloro-3-(trifluoromethyl)phenyl]-trimethylsilane

C10H12ClF3Si — CID 14148758

IUPAC[4-chloro-3-(trifluoromethyl)phenyl]-trimethylsilane
SMILESC[Si](C)(C)c1ccc(Cl)c(C(F)(F)F)c1
InChIInChI=1S/C10H12ClF3Si/c1-15(2,3)7-4-5-9(11)8(6-7)10(12,13)14/h4-6H,1-3H3
InChIKeyHMQOINFOCYQETP-UHFFFAOYSA-N
MW252.74 g/mol
LogP3.90
Rot. Bonds1

About [4-chloro-3-(trifluoromethyl)phenyl]-trimethylsilane

[4-chloro-3-(trifluoromethyl)phenyl]-trimethylsilane (PubChem CID 14148758) has the molecular formula C10H12ClF3Si and a molecular weight of 252.74 g/mol. Its IUPAC name is [4-chloro-3-(trifluoromethyl)phenyl]-trimethylsilane.

Molecular Properties

Compound Name[4-chloro-3-(trifluoromethyl)phenyl]-trimethylsilane
PubChem CID14148758
Molecular FormulaC10H12ClF3Si
Molecular Weight252.74 g/mol
Exact Mass252.03
IUPAC Name[4-chloro-3-(trifluoromethyl)phenyl]-trimethylsilane
SMILESC[Si](C)(C)c1ccc(Cl)c(C(F)(F)F)c1
InChIInChI=1S/C10H12ClF3Si/c1-15(2,3)7-4-5-9(11)8(6-7)10(12,13)14/h4-6H,1-3H3
InChIKeyHMQOINFOCYQETP-UHFFFAOYSA-N
XLogP3.90
TPSA0.00 Ų
H-Bond Donors
H-Bond Acceptors
Rotatable Bonds1
Heavy Atoms15
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500252.74
LogP ≤ 53.90
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

1-Chloro-2-(trifluoromethyl)benzene
CID 6921
2-Chloro-6-fluorotoluene
CID 9933
Benzene, chloro(chlorodifluoromethyl)-
CID 173883
1-Chloro-2-ethylbenzene
CID 6995
2-Chloro-4-fluorotoluene
CID 96747
1-Allyl-2-chlorobenzene
CID 576061
(3-Chlorophenylethynyl)trimethylsilane
CID 4116666
2-Chloro-5-fluorotoluene
CID 118475
2-Chloro-4-methylbenzotrifluoride
CID 2736619
(4-Chlorophenylethynyl)trimethylsilane
CID 3337298
1-Chloro-2-(prop-1-EN-2-YL)benzene
CID 10968208
(alphaE)-beta-(Trifluoromethyl)-4-chlorostyrene
CID 11052806

Frequently Asked Questions

What is the IUPAC name of [4-chloro-3-(trifluoromethyl)phenyl]-trimethylsilane?
The IUPAC name of [4-chloro-3-(trifluoromethyl)phenyl]-trimethylsilane (CID 14148758) is [4-chloro-3-(trifluoromethyl)phenyl]-trimethylsilane.
What is the SMILES notation for [4-chloro-3-(trifluoromethyl)phenyl]-trimethylsilane?
The canonical SMILES for [4-chloro-3-(trifluoromethyl)phenyl]-trimethylsilane is C[Si](C)(C)c1ccc(Cl)c(C(F)(F)F)c1.
What is the InChIKey of [4-chloro-3-(trifluoromethyl)phenyl]-trimethylsilane?
The InChIKey is HMQOINFOCYQETP-UHFFFAOYSA-N. The full InChI is InChI=1S/C10H12ClF3Si/c1-15(2,3)7-4-5-9(11)8(6-7)10(12,13)14/h4-6H,1-3H3.
What are the key properties of [4-chloro-3-(trifluoromethyl)phenyl]-trimethylsilane?
[4-chloro-3-(trifluoromethyl)phenyl]-trimethylsilane has a molecular weight of 252.74 g/mol, XLogP of 3.90, 1 rotatable bonds, 0 hydrogen bond donors, and 0 hydrogen bond acceptors.
Where does this data come from?
All data for [4-chloro-3-(trifluoromethyl)phenyl]-trimethylsilane is sourced from PubChem (CID 14148758), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).