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

C6H6F2O — CID 173042954

IUPAC2,6-difluorocyclohexa-2,4-dien-1-ol
SMILESOC1C(F)=CC=CC1F
InChIInChI=1S/C6H6F2O/c7-4-2-1-3-5(8)6(4)9/h1-4,6,9H
InChIKeyLKMNIAJFNINRSV-UHFFFAOYSA-N
MW132.11 g/mol
LogP1.11
Rot. Bonds

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

2,6-difluorocyclohexa-2,4-dien-1-ol (PubChem CID 173042954) has the molecular formula C6H6F2O and a molecular weight of 132.11 g/mol. Its IUPAC name is 2,6-difluorocyclohexa-2,4-dien-1-ol.

Molecular Properties

Compound Name2,6-difluorocyclohexa-2,4-dien-1-ol
PubChem CID173042954
Molecular FormulaC6H6F2O
Molecular Weight132.11 g/mol
Exact Mass132.04
IUPAC Name2,6-difluorocyclohexa-2,4-dien-1-ol
SMILESOC1C(F)=CC=CC1F
InChIInChI=1S/C6H6F2O/c7-4-2-1-3-5(8)6(4)9/h1-4,6,9H
InChIKeyLKMNIAJFNINRSV-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

1,5-difluoro-6-(methoxymethyl)cyclohexa-1,3-diene
CID 89099264
N-(5-bromopyrazin-2-yl)-2,6-difluorocyclohexa-2,4-diene-1-carboxamide
CID 144761307
5,6-difluorocyclohexa-1,3-diene
CID 22270273
(1R,6S)-2-fluoro-1,6-dihydroxycyclohexa-2,4-diene-1-carboxylic acid
CID 23724764
2-oxalocyclopenta-2,4-diene-1-carboxylic acid
CID 146361988
N-(5-amino-6-hydroxycyclohexa-1,3-dien-1-yl)acetamide
CID 67678738
(6S)-1,4,5,6-tetrafluorocyclohexa-1,3-diene
CID 155000957
diethyl 1-benzyl-4-(5-fluoro-6-methylcyclohexa-2,4-dien-1-yl)-4H-pyridine-3,5-dicarboxylate
CID 163557703
2,3-difluoro-2H-pyran
CID 175126929
6-amino-5-fluoro-6-methylcyclohexa-2,4-dien-1-ol
CID 150149091
(1S)-2-chloro-6-methylcyclohexa-2,4-dien-1-ol
CID 67478277
(1S,2R)-3-prop-2-enylcyclohexa-3,5-diene-1,2-diol
CID 10582954

Frequently Asked Questions

What is the IUPAC name of 2,6-difluorocyclohexa-2,4-dien-1-ol?
The IUPAC name of 2,6-difluorocyclohexa-2,4-dien-1-ol (CID 173042954) is 2,6-difluorocyclohexa-2,4-dien-1-ol.
What is the SMILES notation for 2,6-difluorocyclohexa-2,4-dien-1-ol?
The canonical SMILES for 2,6-difluorocyclohexa-2,4-dien-1-ol is OC1C(F)=CC=CC1F.
What is the InChIKey of 2,6-difluorocyclohexa-2,4-dien-1-ol?
The InChIKey is LKMNIAJFNINRSV-UHFFFAOYSA-N. The full InChI is InChI=1S/C6H6F2O/c7-4-2-1-3-5(8)6(4)9/h1-4,6,9H.
What are the key properties of 2,6-difluorocyclohexa-2,4-dien-1-ol?
2,6-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 2,6-difluorocyclohexa-2,4-dien-1-ol is sourced from PubChem (CID 173042954), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).