2-fluoro-3-methyl-6-prop-2-enylphenol

C10H11FO — CID 107657766

IUPAC2-fluoro-3-methyl-6-prop-2-enylphenol
SMILESC=CCc1ccc(C)c(F)c1O
InChIInChI=1S/C10H11FO/c1-3-4-8-6-5-7(2)9(11)10(8)12/h3,5-6,12H,1,4H2,2H3
InChIKeySLWMJLBGXGYRPS-UHFFFAOYSA-N
MW166.19 g/mol
LogP2.57
Rot. Bonds2

About 2-fluoro-3-methyl-6-prop-2-enylphenol

2-fluoro-3-methyl-6-prop-2-enylphenol (PubChem CID 107657766) has the molecular formula C10H11FO and a molecular weight of 166.19 g/mol. Its IUPAC name is 2-fluoro-3-methyl-6-prop-2-enylphenol.

Molecular Properties

Compound Name2-fluoro-3-methyl-6-prop-2-enylphenol
PubChem CID107657766
Molecular FormulaC10H11FO
Molecular Weight166.19 g/mol
Exact Mass166.08
IUPAC Name2-fluoro-3-methyl-6-prop-2-enylphenol
SMILESC=CCc1ccc(C)c(F)c1O
InChIInChI=1S/C10H11FO/c1-3-4-8-6-5-7(2)9(11)10(8)12/h3,5-6,12H,1,4H2,2H3
InChIKeySLWMJLBGXGYRPS-UHFFFAOYSA-N
XLogP2.57
TPSA20.23 Ų
H-Bond Donors1
H-Bond Acceptors1
Rotatable Bonds2
Heavy Atoms12
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500166.19
LogP ≤ 52.57
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 101

Computed Properties (RDKit)

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

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Related Compounds

2-methoxy-3-methyl-6-prop-2-enylphenol
CID 130034718
6-methyl-3-(2-methylpropyl)-2-prop-2-enylphenol
CID 19012738
3-hydroxy-2-methyl-4-prop-2-enylbenzoic acid
CID 90408616
4-(4-hydroxy-2-methyl-5-prop-2-enylphenyl)-5-methyl-2-prop-2-enylphenol
CID 54433702
bis(cyclopenta-1,3-diene);bis(2-methyl-6-prop-2-enylphenol);zirconium(2+)
CID 141004924
4-methyl-5-prop-2-enylbenzene-1,2-diol
CID 12635732
3-amino-2,6-bis(prop-2-enyl)phenol
CID 158258478
4-bromo-5-methyl-2-prop-2-enylphenol
CID 142719301
4-(chloromethyl)-2,6-bis(prop-2-enyl)phenol
CID 70573204
5-methoxy-2-prop-2-enylphenol
CID 6424515
4-hydroxy-3-methyl-5-prop-2-enylbenzaldehyde
CID 59720398
azane;1-(chloromethyl)-3,4-dimethyl-2-prop-2-enylbenzene
CID 68825933

Frequently Asked Questions

What is the IUPAC name of 2-fluoro-3-methyl-6-prop-2-enylphenol?
The IUPAC name of 2-fluoro-3-methyl-6-prop-2-enylphenol (CID 107657766) is 2-fluoro-3-methyl-6-prop-2-enylphenol.
What is the SMILES notation for 2-fluoro-3-methyl-6-prop-2-enylphenol?
The canonical SMILES for 2-fluoro-3-methyl-6-prop-2-enylphenol is C=CCc1ccc(C)c(F)c1O.
What is the InChIKey of 2-fluoro-3-methyl-6-prop-2-enylphenol?
The InChIKey is SLWMJLBGXGYRPS-UHFFFAOYSA-N. The full InChI is InChI=1S/C10H11FO/c1-3-4-8-6-5-7(2)9(11)10(8)12/h3,5-6,12H,1,4H2,2H3.
What are the key properties of 2-fluoro-3-methyl-6-prop-2-enylphenol?
2-fluoro-3-methyl-6-prop-2-enylphenol has a molecular weight of 166.19 g/mol, XLogP of 2.57, 2 rotatable bonds, 1 hydrogen bond donors, and 1 hydrogen bond acceptors.
Where does this data come from?
All data for 2-fluoro-3-methyl-6-prop-2-enylphenol is sourced from PubChem (CID 107657766), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).