6-fluoro-1,4-dimethylcyclohexa-2,4-dien-1-ol

C8H11FO — CID 174534272

IUPAC6-fluoro-1,4-dimethylcyclohexa-2,4-dien-1-ol
SMILESCC1=CC(F)C(C)(O)C=C1
InChIInChI=1S/C8H11FO/c1-6-3-4-8(2,10)7(9)5-6/h3-5,7,10H,1-2H3
InChIKeyVHOMUJYFKZRIRH-UHFFFAOYSA-N
MW142.17 g/mol
LogP1.59
Rot. Bonds

About 6-fluoro-1,4-dimethylcyclohexa-2,4-dien-1-ol

6-fluoro-1,4-dimethylcyclohexa-2,4-dien-1-ol (PubChem CID 174534272) has the molecular formula C8H11FO and a molecular weight of 142.17 g/mol. Its IUPAC name is 6-fluoro-1,4-dimethylcyclohexa-2,4-dien-1-ol.

Molecular Properties

Compound Name6-fluoro-1,4-dimethylcyclohexa-2,4-dien-1-ol
PubChem CID174534272
Molecular FormulaC8H11FO
Molecular Weight142.17 g/mol
Exact Mass142.08
IUPAC Name6-fluoro-1,4-dimethylcyclohexa-2,4-dien-1-ol
SMILESCC1=CC(F)C(C)(O)C=C1
InChIInChI=1S/C8H11FO/c1-6-3-4-8(2,10)7(9)5-6/h3-5,7,10H,1-2H3
InChIKeyVHOMUJYFKZRIRH-UHFFFAOYSA-N
XLogP1.59
TPSA20.23 Ų
H-Bond Donors1
H-Bond Acceptors1
Rotatable Bonds
Heavy Atoms10
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500142.17
LogP ≤ 51.59
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 101

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Frequently Asked Questions

What is the IUPAC name of 6-fluoro-1,4-dimethylcyclohexa-2,4-dien-1-ol?
The IUPAC name of 6-fluoro-1,4-dimethylcyclohexa-2,4-dien-1-ol (CID 174534272) is 6-fluoro-1,4-dimethylcyclohexa-2,4-dien-1-ol.
What is the SMILES notation for 6-fluoro-1,4-dimethylcyclohexa-2,4-dien-1-ol?
The canonical SMILES for 6-fluoro-1,4-dimethylcyclohexa-2,4-dien-1-ol is CC1=CC(F)C(C)(O)C=C1.
What is the InChIKey of 6-fluoro-1,4-dimethylcyclohexa-2,4-dien-1-ol?
The InChIKey is VHOMUJYFKZRIRH-UHFFFAOYSA-N. The full InChI is InChI=1S/C8H11FO/c1-6-3-4-8(2,10)7(9)5-6/h3-5,7,10H,1-2H3.
What are the key properties of 6-fluoro-1,4-dimethylcyclohexa-2,4-dien-1-ol?
6-fluoro-1,4-dimethylcyclohexa-2,4-dien-1-ol has a molecular weight of 142.17 g/mol, XLogP of 1.59, 0 rotatable bonds, 1 hydrogen bond donors, and 1 hydrogen bond acceptors.
Where does this data come from?
All data for 6-fluoro-1,4-dimethylcyclohexa-2,4-dien-1-ol is sourced from PubChem (CID 174534272), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).