1,3,4,6-tetrafluorocyclohexa-2,4-dien-1-ol

C6H4F4O — CID 19760670

IUPAC1,3,4,6-tetrafluorocyclohexa-2,4-dien-1-ol
SMILESOC1(F)C=C(F)C(F)=CC1F
InChIInChI=1S/C6H4F4O/c7-3-1-5(9)6(10,11)2-4(3)8/h1-2,5,11H
InChIKeyOVKYRDFILQPCDV-UHFFFAOYSA-N
MW168.09 g/mol
LogP1.70
Rot. Bonds

About 1,3,4,6-tetrafluorocyclohexa-2,4-dien-1-ol

1,3,4,6-tetrafluorocyclohexa-2,4-dien-1-ol (PubChem CID 19760670) has the molecular formula C6H4F4O and a molecular weight of 168.09 g/mol. Its IUPAC name is 1,3,4,6-tetrafluorocyclohexa-2,4-dien-1-ol.

Molecular Properties

Compound Name1,3,4,6-tetrafluorocyclohexa-2,4-dien-1-ol
PubChem CID19760670
Molecular FormulaC6H4F4O
Molecular Weight168.09 g/mol
Exact Mass168.02
IUPAC Name1,3,4,6-tetrafluorocyclohexa-2,4-dien-1-ol
SMILESOC1(F)C=C(F)C(F)=CC1F
InChIInChI=1S/C6H4F4O/c7-3-1-5(9)6(10,11)2-4(3)8/h1-2,5,11H
InChIKeyOVKYRDFILQPCDV-UHFFFAOYSA-N
XLogP1.70
TPSA20.23 Ų
H-Bond Donors1
H-Bond Acceptors1
Rotatable Bonds
Heavy Atoms11
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500168.09
LogP ≤ 51.70
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 101

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Related Compounds

2,6-Difluorocyclohexa-1,5-dien-1-ol
CID 142307514
1-Fluorocyclohexa-2,4-dien-1-ol
CID 20201527
1,6-Difluorocyclohexa-2,4-dien-1-ol
CID 22027063
2,3,4,6-Tetrafluroresorcinol
CID 22672482
1,3,6-Trifluorocyclohexa-2,4-dien-1-ol
CID 67532845
2,4-Difluorocyclohexa-1,5-diene-1,4-diol
CID 68897124
3,3,4,5,6-Pentafluorocyclohexa-1,5-dien-1-ol
CID 88335738
1,2,5,6-Tetrafluorocyclohexa-3,5-diene-1,3-diol
CID 88335801
5,6-Difluorocyclohexa-1,5-dien-1-ol
CID 89045871
2,3,4,5-Tetrafluorocyclohexa-1,5-diene-1,4-diol
CID 89420440
1,3,5-Trifluorocyclohexa-2,4-dien-1-ol
CID 89765023
4-Bromo-1,2-difluorocyclohexa-2,4-dien-1-ol
CID 90421358

Frequently Asked Questions

What is the IUPAC name of 1,3,4,6-tetrafluorocyclohexa-2,4-dien-1-ol?
The IUPAC name of 1,3,4,6-tetrafluorocyclohexa-2,4-dien-1-ol (CID 19760670) is 1,3,4,6-tetrafluorocyclohexa-2,4-dien-1-ol.
What is the SMILES notation for 1,3,4,6-tetrafluorocyclohexa-2,4-dien-1-ol?
The canonical SMILES for 1,3,4,6-tetrafluorocyclohexa-2,4-dien-1-ol is OC1(F)C=C(F)C(F)=CC1F.
What is the InChIKey of 1,3,4,6-tetrafluorocyclohexa-2,4-dien-1-ol?
The InChIKey is OVKYRDFILQPCDV-UHFFFAOYSA-N. The full InChI is InChI=1S/C6H4F4O/c7-3-1-5(9)6(10,11)2-4(3)8/h1-2,5,11H.
What are the key properties of 1,3,4,6-tetrafluorocyclohexa-2,4-dien-1-ol?
1,3,4,6-tetrafluorocyclohexa-2,4-dien-1-ol has a molecular weight of 168.09 g/mol, XLogP of 1.70, 0 rotatable bonds, 1 hydrogen bond donors, and 1 hydrogen bond acceptors.
Where does this data come from?
All data for 1,3,4,6-tetrafluorocyclohexa-2,4-dien-1-ol is sourced from PubChem (CID 19760670), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).