1,2,3,4,5,6-hexafluorocyclohexa-2,4-dien-1-ol

C6H2F6O — CID 175095832

IUPAC1,2,3,4,5,6-hexafluorocyclohexa-2,4-dien-1-ol
SMILESOC1(F)C(F)=C(F)C(F)=C(F)C1F
InChIInChI=1S/C6H2F6O/c7-1-2(8)4(10)6(12,13)5(11)3(1)9/h4,13H
InChIKeyKPBJBKLHQZOAQP-UHFFFAOYSA-N
MW204.07 g/mol
LogP2.30
Rot. Bonds

About 1,2,3,4,5,6-hexafluorocyclohexa-2,4-dien-1-ol

1,2,3,4,5,6-hexafluorocyclohexa-2,4-dien-1-ol (PubChem CID 175095832) has the molecular formula C6H2F6O and a molecular weight of 204.07 g/mol. Its IUPAC name is 1,2,3,4,5,6-hexafluorocyclohexa-2,4-dien-1-ol.

Molecular Properties

Compound Name1,2,3,4,5,6-hexafluorocyclohexa-2,4-dien-1-ol
PubChem CID175095832
Molecular FormulaC6H2F6O
Molecular Weight204.07 g/mol
Exact Mass204.00
IUPAC Name1,2,3,4,5,6-hexafluorocyclohexa-2,4-dien-1-ol
SMILESOC1(F)C(F)=C(F)C(F)=C(F)C1F
InChIInChI=1S/C6H2F6O/c7-1-2(8)4(10)6(12,13)5(11)3(1)9/h4,13H
InChIKeyKPBJBKLHQZOAQP-UHFFFAOYSA-N
XLogP2.30
TPSA20.23 Ų
H-Bond Donors1
H-Bond Acceptors1
Rotatable Bonds
Heavy Atoms13
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500204.07
LogP ≤ 52.30
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 101

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Related Compounds

2,3,4,5,6-pentafluoro-1-(1,2,2-trifluoroethenyl)cyclohexa-2,4-dien-1-ol
CID 87325926
bis[2,3,4,5,6-pentafluoro-1-(trifluoromethyl)cyclohexa-2,4-dien-1-yl]methanone
CID 141331157
2,3,4,5-tetrafluorocyclohexa-1,5-diene-1,4-diol
CID 89420440
1-ethylsulfonyl-N-(1-ethylsulfonyl-2,3,4,5,6-pentafluorocyclohexa-2,4-dien-1-yl)-2,3,4,5,6-pentafluorocyclohexa-2,4-dien-1-amine
CID 172756898
2,3,4,5,6-pentafluoro-4-(1,2,3,5,6-pentafluoro-4-hydroxycyclohexa-2,4-dien-1-yl)sulfanylcyclohexa-1,5-dien-1-ol
CID 175402832
(2,3,4,5,6-pentafluoro-6-methylcyclohexa-2,4-dien-1-yl)methanol
CID 70672909
(2,3,4,5,6-pentafluoro-1-hexylcyclohexa-2,4-dien-1-yl)boronic acid
CID 141064374
tetrakis(1,2,3,4,5-pentafluoro-6-methylcyclohexa-2,4-dien-1-yl)boranuide
CID 174225846
(2,3,4,5,6-pentafluoro-1-methylcyclohexa-2,4-dien-1-yl)-bis(2,3,4,5,6-pentafluorophenoxy)borane
CID 141371951
1,3,4,5,6,7,8,9,10-nonafluoro-2H-anthracene-1,2-diol
CID 87916942
rutherfordium;2,2,3-trifluorocyclopropan-1-ol
CID 59685229
2,3,4,5,6-pentafluoro-7-oxabicyclo[4.1.0]hepta-2,4-dien-1-ol
CID 154636951

Frequently Asked Questions

What is the IUPAC name of 1,2,3,4,5,6-hexafluorocyclohexa-2,4-dien-1-ol?
The IUPAC name of 1,2,3,4,5,6-hexafluorocyclohexa-2,4-dien-1-ol (CID 175095832) is 1,2,3,4,5,6-hexafluorocyclohexa-2,4-dien-1-ol.
What is the SMILES notation for 1,2,3,4,5,6-hexafluorocyclohexa-2,4-dien-1-ol?
The canonical SMILES for 1,2,3,4,5,6-hexafluorocyclohexa-2,4-dien-1-ol is OC1(F)C(F)=C(F)C(F)=C(F)C1F.
What is the InChIKey of 1,2,3,4,5,6-hexafluorocyclohexa-2,4-dien-1-ol?
The InChIKey is KPBJBKLHQZOAQP-UHFFFAOYSA-N. The full InChI is InChI=1S/C6H2F6O/c7-1-2(8)4(10)6(12,13)5(11)3(1)9/h4,13H.
What are the key properties of 1,2,3,4,5,6-hexafluorocyclohexa-2,4-dien-1-ol?
1,2,3,4,5,6-hexafluorocyclohexa-2,4-dien-1-ol has a molecular weight of 204.07 g/mol, XLogP of 2.30, 0 rotatable bonds, 1 hydrogen bond donors, and 1 hydrogen bond acceptors.
Where does this data come from?
All data for 1,2,3,4,5,6-hexafluorocyclohexa-2,4-dien-1-ol is sourced from PubChem (CID 175095832), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).