1-fluoro-4-(2-methylprop-2-enyl)benzene

C10H11F — CID 10954713

IUPAC1-fluoro-4-(2-methylprop-2-enyl)benzene
SMILESC=C(C)Cc1ccc(F)cc1
InChIInChI=1S/C10H11F/c1-8(2)7-9-3-5-10(11)6-4-9/h3-6H,1,7H2,2H3
InChIKeyXYRWSYCXWUUXER-UHFFFAOYSA-N
MW150.20 g/mol
LogP2.94
Rot. Bonds2

About 1-fluoro-4-(2-methylprop-2-enyl)benzene

1-fluoro-4-(2-methylprop-2-enyl)benzene (PubChem CID 10954713) has the molecular formula C10H11F and a molecular weight of 150.20 g/mol. Its IUPAC name is 1-fluoro-4-(2-methylprop-2-enyl)benzene.

Molecular Properties

Compound Name1-fluoro-4-(2-methylprop-2-enyl)benzene
PubChem CID10954713
Molecular FormulaC10H11F
Molecular Weight150.20 g/mol
Exact Mass150.08
IUPAC Name1-fluoro-4-(2-methylprop-2-enyl)benzene
SMILESC=C(C)Cc1ccc(F)cc1
InChIInChI=1S/C10H11F/c1-8(2)7-9-3-5-10(11)6-4-9/h3-6H,1,7H2,2H3
InChIKeyXYRWSYCXWUUXER-UHFFFAOYSA-N
XLogP2.94
TPSA0.00 Ų
H-Bond Donors
H-Bond Acceptors
Rotatable Bonds2
Heavy Atoms11
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500150.20
LogP ≤ 52.94
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 100

Computed Properties (RDKit)

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

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Related Compounds

1-fluoro-4-(2-methylidenebutyl)benzene
CID 91243133
1-fluoro-4-(3-methylbut-3-enyl)benzene
CID 24721825
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CID 117266723
1-(4-fluorophenyl)butane-2,3-dione
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(NZ)-N-[1-(4-fluorophenyl)propan-2-ylidene]hydroxylamine
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2-fluoro-4-(2-methylprop-2-enyl)phenol
CID 142516267
2-fluoro-4-(2-methylprop-2-enyl)-1-methylsulfanylbenzene
CID 67531286
1,3-bis(4-fluorophenyl)propan-2-ylidenezirconium(2+)
CID 87754590
N-[4-(2-methylprop-2-enyl)phenyl]acetamide
CID 89105480
1-(4-fluorophenyl)pentane-2,4-dione
CID 57447744
[1-(4-fluorophenyl)-3-methylbut-2-en-2-yl]-trimethylsilane
CID 10776227
3-[4-(2-methylprop-2-enyl)phenyl]butanal
CID 121334170

Frequently Asked Questions

What is the IUPAC name of 1-fluoro-4-(2-methylprop-2-enyl)benzene?
The IUPAC name of 1-fluoro-4-(2-methylprop-2-enyl)benzene (CID 10954713) is 1-fluoro-4-(2-methylprop-2-enyl)benzene.
What is the SMILES notation for 1-fluoro-4-(2-methylprop-2-enyl)benzene?
The canonical SMILES for 1-fluoro-4-(2-methylprop-2-enyl)benzene is C=C(C)Cc1ccc(F)cc1.
What is the InChIKey of 1-fluoro-4-(2-methylprop-2-enyl)benzene?
The InChIKey is XYRWSYCXWUUXER-UHFFFAOYSA-N. The full InChI is InChI=1S/C10H11F/c1-8(2)7-9-3-5-10(11)6-4-9/h3-6H,1,7H2,2H3.
What are the key properties of 1-fluoro-4-(2-methylprop-2-enyl)benzene?
1-fluoro-4-(2-methylprop-2-enyl)benzene has a molecular weight of 150.20 g/mol, XLogP of 2.94, 2 rotatable bonds, 0 hydrogen bond donors, and 0 hydrogen bond acceptors.
Where does this data come from?
All data for 1-fluoro-4-(2-methylprop-2-enyl)benzene is sourced from PubChem (CID 10954713), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).