2,3-difluoro-5,6-dimethylcyclohexa-1,3-diene

C8H10F2 — CID 154525018

IUPAC2,3-difluoro-5,6-dimethylcyclohexa-1,3-diene
SMILESCC1C=C(F)C(F)=CC1C
InChIInChI=1S/C8H10F2/c1-5-3-7(9)8(10)4-6(5)2/h3-6H,1-2H3
InChIKeyGDZANGWMPOXHQI-UHFFFAOYSA-N
MW144.16 g/mol
LogP2.98
Rot. Bonds

About 2,3-difluoro-5,6-dimethylcyclohexa-1,3-diene

2,3-difluoro-5,6-dimethylcyclohexa-1,3-diene (PubChem CID 154525018) has the molecular formula C8H10F2 and a molecular weight of 144.16 g/mol. Its IUPAC name is 2,3-difluoro-5,6-dimethylcyclohexa-1,3-diene.

Molecular Properties

Compound Name2,3-difluoro-5,6-dimethylcyclohexa-1,3-diene
PubChem CID154525018
Molecular FormulaC8H10F2
Molecular Weight144.16 g/mol
Exact Mass144.08
IUPAC Name2,3-difluoro-5,6-dimethylcyclohexa-1,3-diene
SMILESCC1C=C(F)C(F)=CC1C
InChIInChI=1S/C8H10F2/c1-5-3-7(9)8(10)4-6(5)2/h3-6H,1-2H3
InChIKeyGDZANGWMPOXHQI-UHFFFAOYSA-N
XLogP2.98
TPSA0.00 Ų
H-Bond Donors
H-Bond Acceptors
Rotatable Bonds
Heavy Atoms10
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500144.16
LogP ≤ 52.98
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 100

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Frequently Asked Questions

What is the IUPAC name of 2,3-difluoro-5,6-dimethylcyclohexa-1,3-diene?
The IUPAC name of 2,3-difluoro-5,6-dimethylcyclohexa-1,3-diene (CID 154525018) is 2,3-difluoro-5,6-dimethylcyclohexa-1,3-diene.
What is the SMILES notation for 2,3-difluoro-5,6-dimethylcyclohexa-1,3-diene?
The canonical SMILES for 2,3-difluoro-5,6-dimethylcyclohexa-1,3-diene is CC1C=C(F)C(F)=CC1C.
What is the InChIKey of 2,3-difluoro-5,6-dimethylcyclohexa-1,3-diene?
The InChIKey is GDZANGWMPOXHQI-UHFFFAOYSA-N. The full InChI is InChI=1S/C8H10F2/c1-5-3-7(9)8(10)4-6(5)2/h3-6H,1-2H3.
What are the key properties of 2,3-difluoro-5,6-dimethylcyclohexa-1,3-diene?
2,3-difluoro-5,6-dimethylcyclohexa-1,3-diene has a molecular weight of 144.16 g/mol, XLogP of 2.98, 0 rotatable bonds, 0 hydrogen bond donors, and 0 hydrogen bond acceptors.
Where does this data come from?
All data for 2,3-difluoro-5,6-dimethylcyclohexa-1,3-diene is sourced from PubChem (CID 154525018), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).