1,6-difluorocyclohexa-2,4-dien-1-ol

C6H6F2O — CID 22027063

IUPAC1,6-difluorocyclohexa-2,4-dien-1-ol
SMILESOC1(F)C=CC=CC1F
InChIInChI=1S/C6H6F2O/c7-5-3-1-2-4-6(5,8)9/h1-5,9H
InChIKeyWKOSNPSMXAJSPU-UHFFFAOYSA-N
MW132.11 g/mol
LogP1.11
Rot. Bonds

About 1,6-difluorocyclohexa-2,4-dien-1-ol

1,6-difluorocyclohexa-2,4-dien-1-ol (PubChem CID 22027063) has the molecular formula C6H6F2O and a molecular weight of 132.11 g/mol. Its IUPAC name is 1,6-difluorocyclohexa-2,4-dien-1-ol.

Molecular Properties

Compound Name1,6-difluorocyclohexa-2,4-dien-1-ol
PubChem CID22027063
Molecular FormulaC6H6F2O
Molecular Weight132.11 g/mol
Exact Mass132.04
IUPAC Name1,6-difluorocyclohexa-2,4-dien-1-ol
SMILESOC1(F)C=CC=CC1F
InChIInChI=1S/C6H6F2O/c7-5-3-1-2-4-6(5,8)9/h1-5,9H
InChIKeyWKOSNPSMXAJSPU-UHFFFAOYSA-N
XLogP1.11
TPSA20.23 Ų
H-Bond Donors1
H-Bond Acceptors1
Rotatable Bonds
Heavy Atoms9
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500132.11
LogP ≤ 51.11
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 101

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Related Compounds

2,6-Difluorocyclohexa-1,5-dien-1-ol
CID 142307514
6-Fluorocyclohexa-2,4-dien-1-ol
CID 134894964
1-(Trifluoromethyl)cyclohexa-2,4-dien-1-ol
CID 139242865
1,3,4,6-Tetrafluorocyclohexa-2,4-dien-1-ol
CID 19760670
1-Fluorocyclohexa-2,4-dien-1-ol
CID 20201527
1-Bromo-3,5-difluorocyclohexa-2,4-dien-1-ol
CID 22118090
4-Chloro-1-fluorophenol
CID 22482861
1-Fluorocyclohexa-3,5-diene-1,3-diol
CID 22996723
1,3,6-Trifluorocyclohexa-2,4-dien-1-ol
CID 67532845
1-Bromo-5-fluorocyclohexa-2,4-dien-1-ol
CID 67589329
5-Fluorocyclohexa-1,5-dien-1-ol
CID 68353020
2,4-Difluorocyclohexa-1,5-diene-1,4-diol
CID 68897124

Frequently Asked Questions

What is the IUPAC name of 1,6-difluorocyclohexa-2,4-dien-1-ol?
The IUPAC name of 1,6-difluorocyclohexa-2,4-dien-1-ol (CID 22027063) is 1,6-difluorocyclohexa-2,4-dien-1-ol.
What is the SMILES notation for 1,6-difluorocyclohexa-2,4-dien-1-ol?
The canonical SMILES for 1,6-difluorocyclohexa-2,4-dien-1-ol is OC1(F)C=CC=CC1F.
What is the InChIKey of 1,6-difluorocyclohexa-2,4-dien-1-ol?
The InChIKey is WKOSNPSMXAJSPU-UHFFFAOYSA-N. The full InChI is InChI=1S/C6H6F2O/c7-5-3-1-2-4-6(5,8)9/h1-5,9H.
What are the key properties of 1,6-difluorocyclohexa-2,4-dien-1-ol?
1,6-difluorocyclohexa-2,4-dien-1-ol has a molecular weight of 132.11 g/mol, XLogP of 1.11, 0 rotatable bonds, 1 hydrogen bond donors, and 1 hydrogen bond acceptors.
Where does this data come from?
All data for 1,6-difluorocyclohexa-2,4-dien-1-ol is sourced from PubChem (CID 22027063), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).