6-fluoro-1-methyl-4-prop-1-en-2-ylcyclohexene

C10H15F — CID 134969062

IUPAC6-fluoro-1-methyl-4-prop-1-en-2-ylcyclohexene
SMILESC=C(C)C1CC=C(C)C(F)C1
InChIInChI=1S/C10H15F/c1-7(2)9-5-4-8(3)10(11)6-9/h4,9-10H,1,5-6H2,2-3H3
InChIKeyMYLVRTCULOVAHV-UHFFFAOYSA-N
MW154.23 g/mol
LogP3.26
Rot. Bonds1

About 6-fluoro-1-methyl-4-prop-1-en-2-ylcyclohexene

6-fluoro-1-methyl-4-prop-1-en-2-ylcyclohexene (PubChem CID 134969062) has the molecular formula C10H15F and a molecular weight of 154.23 g/mol. Its IUPAC name is 6-fluoro-1-methyl-4-prop-1-en-2-ylcyclohexene.

Molecular Properties

Compound Name6-fluoro-1-methyl-4-prop-1-en-2-ylcyclohexene
PubChem CID134969062
Molecular FormulaC10H15F
Molecular Weight154.23 g/mol
Exact Mass154.12
IUPAC Name6-fluoro-1-methyl-4-prop-1-en-2-ylcyclohexene
SMILESC=C(C)C1CC=C(C)C(F)C1
InChIInChI=1S/C10H15F/c1-7(2)9-5-4-8(3)10(11)6-9/h4,9-10H,1,5-6H2,2-3H3
InChIKeyMYLVRTCULOVAHV-UHFFFAOYSA-N
XLogP3.26
TPSA0.00 Ų
H-Bond Donors
H-Bond Acceptors
Rotatable Bonds1
Heavy Atoms11
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500154.23
LogP ≤ 53.26
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 100

Computed Properties (RDKit)

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

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Frequently Asked Questions

What is the IUPAC name of 6-fluoro-1-methyl-4-prop-1-en-2-ylcyclohexene?
The IUPAC name of 6-fluoro-1-methyl-4-prop-1-en-2-ylcyclohexene (CID 134969062) is 6-fluoro-1-methyl-4-prop-1-en-2-ylcyclohexene.
What is the SMILES notation for 6-fluoro-1-methyl-4-prop-1-en-2-ylcyclohexene?
The canonical SMILES for 6-fluoro-1-methyl-4-prop-1-en-2-ylcyclohexene is C=C(C)C1CC=C(C)C(F)C1.
What is the InChIKey of 6-fluoro-1-methyl-4-prop-1-en-2-ylcyclohexene?
The InChIKey is MYLVRTCULOVAHV-UHFFFAOYSA-N. The full InChI is InChI=1S/C10H15F/c1-7(2)9-5-4-8(3)10(11)6-9/h4,9-10H,1,5-6H2,2-3H3.
What are the key properties of 6-fluoro-1-methyl-4-prop-1-en-2-ylcyclohexene?
6-fluoro-1-methyl-4-prop-1-en-2-ylcyclohexene has a molecular weight of 154.23 g/mol, XLogP of 3.26, 1 rotatable bonds, 0 hydrogen bond donors, and 0 hydrogen bond acceptors.
Where does this data come from?
All data for 6-fluoro-1-methyl-4-prop-1-en-2-ylcyclohexene is sourced from PubChem (CID 134969062), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).