(4-fluoro-2,6-dimethylphenyl)-(3-fluorophenyl)diazene

C14H12F2N2 — CID 166445658

IUPAC(4-fluoro-2,6-dimethylphenyl)-(3-fluorophenyl)diazene
SMILESCc1cc(F)cc(C)c1/N=N/c1cccc(F)c1
InChIInChI=1S/C14H12F2N2/c1-9-6-12(16)7-10(2)14(9)18-17-13-5-3-4-11(15)8-13/h3-8H,1-2H3/b18-17+
InChIKeyJLWWBMUPSNKHFT-ISLYRVAYSA-N
MW246.26 g/mol
LogP5.00
Rot. Bonds2

About (4-fluoro-2,6-dimethylphenyl)-(3-fluorophenyl)diazene

(4-fluoro-2,6-dimethylphenyl)-(3-fluorophenyl)diazene (PubChem CID 166445658) has the molecular formula C14H12F2N2 and a molecular weight of 246.26 g/mol. Its IUPAC name is (4-fluoro-2,6-dimethylphenyl)-(3-fluorophenyl)diazene.

Molecular Properties

Compound Name(4-fluoro-2,6-dimethylphenyl)-(3-fluorophenyl)diazene
PubChem CID166445658
Molecular FormulaC14H12F2N2
Molecular Weight246.26 g/mol
Exact Mass246.10
IUPAC Name(4-fluoro-2,6-dimethylphenyl)-(3-fluorophenyl)diazene
SMILESCc1cc(F)cc(C)c1/N=N/c1cccc(F)c1
InChIInChI=1S/C14H12F2N2/c1-9-6-12(16)7-10(2)14(9)18-17-13-5-3-4-11(15)8-13/h3-8H,1-2H3/b18-17+
InChIKeyJLWWBMUPSNKHFT-ISLYRVAYSA-N
XLogP5.00
TPSA24.72 Ų
H-Bond Donors
H-Bond Acceptors2
Rotatable Bonds2
Heavy Atoms18
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500246.26
LogP ≤ 55.00
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 102

Computed Properties (RDKit)

Structural Alerts{'alert_name': 'azo_A(324)', 'substructure': 'N/A'}, {'alert_name': 'diazo_group', 'substructure': 'N/A'}

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Related Compounds

4-[(3-fluorophenyl)diazenyl]-1H-pyrazole-3,5-diamine
CID 694534
2,4,6-tris[(3-methylphenyl)diazenyl]benzene-1,3,5-triamine
CID 71410872
4-[(2,6-dimethylphenyl)diazenyl]-3,5-dimethylaniline
CID 102503895
(Z)-3-[(3-fluorophenyl)diazenyl]-4-hydroxypent-3-en-2-one
CID 135672253
ethane;1-fluoro-3-methylbenzene
CID 123790085
4-[[7-[(4-hydroxy-2,6-dimethylphenyl)diazenyl]naphthalen-2-yl]diazenyl]-3,5-dimethylphenol
CID 578807
1,1-difluoro-N-(3-fluorophenyl)propan-2-imine
CID 130247360
sodium [(3-fluorophenyl)diazenyl]-methoxyphosphinate
CID 117061605
1-fluoro-3-(sulfonylamino)benzene
CID 151719875
1,3-difluorobenzene;methanol
CID 144994633
(4-fluoro-2,6-dimethylphenyl)-(3-fluorophenyl)methanone
CID 106877008
N-(3-fluorophenyl)-1-(2,4,6-trifluorophenyl)methanimine
CID 23329282

Frequently Asked Questions

What is the IUPAC name of (4-fluoro-2,6-dimethylphenyl)-(3-fluorophenyl)diazene?
The IUPAC name of (4-fluoro-2,6-dimethylphenyl)-(3-fluorophenyl)diazene (CID 166445658) is (4-fluoro-2,6-dimethylphenyl)-(3-fluorophenyl)diazene.
What is the SMILES notation for (4-fluoro-2,6-dimethylphenyl)-(3-fluorophenyl)diazene?
The canonical SMILES for (4-fluoro-2,6-dimethylphenyl)-(3-fluorophenyl)diazene is Cc1cc(F)cc(C)c1/N=N/c1cccc(F)c1.
What is the InChIKey of (4-fluoro-2,6-dimethylphenyl)-(3-fluorophenyl)diazene?
The InChIKey is JLWWBMUPSNKHFT-ISLYRVAYSA-N. The full InChI is InChI=1S/C14H12F2N2/c1-9-6-12(16)7-10(2)14(9)18-17-13-5-3-4-11(15)8-13/h3-8H,1-2H3/b18-17+.
What are the key properties of (4-fluoro-2,6-dimethylphenyl)-(3-fluorophenyl)diazene?
(4-fluoro-2,6-dimethylphenyl)-(3-fluorophenyl)diazene has a molecular weight of 246.26 g/mol, XLogP of 5.00, 2 rotatable bonds, 0 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for (4-fluoro-2,6-dimethylphenyl)-(3-fluorophenyl)diazene is sourced from PubChem (CID 166445658), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).