1-fluoro-4-prop-1-enyl-2-(trifluoromethyl)benzene

C10H8F4 — CID 173058439

IUPAC1-fluoro-4-prop-1-enyl-2-(trifluoromethyl)benzene
SMILESCC=Cc1ccc(F)c(C(F)(F)F)c1
InChIInChI=1S/C10H8F4/c1-2-3-7-4-5-9(11)8(6-7)10(12,13)14/h2-6H,1H3
InChIKeyBKXMOTISVINUFJ-UHFFFAOYSA-N
MW204.17 g/mol
LogP3.88
Rot. Bonds1

About 1-fluoro-4-prop-1-enyl-2-(trifluoromethyl)benzene

1-fluoro-4-prop-1-enyl-2-(trifluoromethyl)benzene (PubChem CID 173058439) has the molecular formula C10H8F4 and a molecular weight of 204.17 g/mol. Its IUPAC name is 1-fluoro-4-prop-1-enyl-2-(trifluoromethyl)benzene.

Molecular Properties

Compound Name1-fluoro-4-prop-1-enyl-2-(trifluoromethyl)benzene
PubChem CID173058439
Molecular FormulaC10H8F4
Molecular Weight204.17 g/mol
Exact Mass204.06
IUPAC Name1-fluoro-4-prop-1-enyl-2-(trifluoromethyl)benzene
SMILESCC=Cc1ccc(F)c(C(F)(F)F)c1
InChIInChI=1S/C10H8F4/c1-2-3-7-4-5-9(11)8(6-7)10(12,13)14/h2-6H,1H3
InChIKeyBKXMOTISVINUFJ-UHFFFAOYSA-N
XLogP3.88
TPSA0.00 Ų
H-Bond Donors
H-Bond Acceptors
Rotatable Bonds1
Heavy Atoms14
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500204.17
LogP ≤ 53.88
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 100

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Related Compounds

1-bromo-4-prop-1-enyl-2-(trifluoromethyl)benzene
CID 141113367
1-fluoro-4-(2-methylprop-1-enyl)-2-(trifluoromethyl)benzene
CID 23105944
(Z)-3-[4-fluoro-3-(trifluoromethyl)phenyl]prop-2-enoic acid
CID 92907805
4-[4-fluoro-3-(trifluoromethyl)phenyl]but-3-enenitrile
CID 170800175
(E)-3-[4-fluoro-3-(trifluoromethyl)phenyl]prop-2-enoyl chloride
CID 57478964
4-(4-bromobut-1-enyl)-1-fluoro-2-(trifluoromethyl)benzene
CID 170497926
2-[2-[4-fluoro-3-(trifluoromethyl)phenyl]ethenyl]-6-methylpyridine
CID 54485530
4-[4-fluoro-3-(trifluoromethyl)phenyl]but-3-enoic acid
CID 170484034
(E)-4-[4-fluoro-3-(trifluoromethyl)phenyl]-N-propylbut-3-en-1-amine
CID 107290638
S-[4-[4-fluoro-3-(trifluoromethyl)phenyl]but-3-enyl] ethanethioate
CID 170480609
(E)-4-[4-fluoro-3-(trifluoromethyl)phenyl]-N,3-dimethylbut-3-en-2-amine
CID 103092888
4-chloro-2-[(E)-prop-1-enyl]-1-(trifluoromethyl)benzene
CID 173483379

Frequently Asked Questions

What is the IUPAC name of 1-fluoro-4-prop-1-enyl-2-(trifluoromethyl)benzene?
The IUPAC name of 1-fluoro-4-prop-1-enyl-2-(trifluoromethyl)benzene (CID 173058439) is 1-fluoro-4-prop-1-enyl-2-(trifluoromethyl)benzene.
What is the SMILES notation for 1-fluoro-4-prop-1-enyl-2-(trifluoromethyl)benzene?
The canonical SMILES for 1-fluoro-4-prop-1-enyl-2-(trifluoromethyl)benzene is CC=Cc1ccc(F)c(C(F)(F)F)c1.
What is the InChIKey of 1-fluoro-4-prop-1-enyl-2-(trifluoromethyl)benzene?
The InChIKey is BKXMOTISVINUFJ-UHFFFAOYSA-N. The full InChI is InChI=1S/C10H8F4/c1-2-3-7-4-5-9(11)8(6-7)10(12,13)14/h2-6H,1H3.
What are the key properties of 1-fluoro-4-prop-1-enyl-2-(trifluoromethyl)benzene?
1-fluoro-4-prop-1-enyl-2-(trifluoromethyl)benzene has a molecular weight of 204.17 g/mol, XLogP of 3.88, 1 rotatable bonds, 0 hydrogen bond donors, and 0 hydrogen bond acceptors.
Where does this data come from?
All data for 1-fluoro-4-prop-1-enyl-2-(trifluoromethyl)benzene is sourced from PubChem (CID 173058439), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).