1-(2,6-difluorophenyl)ethyldiazene

C8H8F2N2 — CID 91333459

IUPAC1-(2,6-difluorophenyl)ethyldiazene
SMILES[H]/N=N/C(C)c1c(F)cccc1F
InChIInChI=1S/C8H8F2N2/c1-5(12-11)8-6(9)3-2-4-7(8)10/h2-5,11H,1H3/b12-11+
InChIKeyKWNXTBUODITTMW-VAWYXSNFSA-N
MW170.16 g/mol
LogP3.06
Rot. Bonds2

About 1-(2,6-difluorophenyl)ethyldiazene

1-(2,6-difluorophenyl)ethyldiazene (PubChem CID 91333459) has the molecular formula C8H8F2N2 and a molecular weight of 170.16 g/mol. Its IUPAC name is 1-(2,6-difluorophenyl)ethyldiazene.

Molecular Properties

Compound Name1-(2,6-difluorophenyl)ethyldiazene
PubChem CID91333459
Molecular FormulaC8H8F2N2
Molecular Weight170.16 g/mol
Exact Mass170.07
IUPAC Name1-(2,6-difluorophenyl)ethyldiazene
SMILES[H]/N=N/C(C)c1c(F)cccc1F
InChIInChI=1S/C8H8F2N2/c1-5(12-11)8-6(9)3-2-4-7(8)10/h2-5,11H,1H3/b12-11+
InChIKeyKWNXTBUODITTMW-VAWYXSNFSA-N
XLogP3.06
TPSA36.21 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds2
Heavy Atoms12
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500170.16
LogP ≤ 53.06
H-Bond Donors ≤ 51
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

2-diazenyl-2-(2,6-difluorophenyl)acetaldehyde
CID 91586017
1-(2,6-difluorophenyl)ethanol
CID 5012075
2-butan-2-yl-1,3-difluorobenzene
CID 56605716
N-[1-(2,6-difluorophenyl)ethyl]hydroxylamine
CID 82684718
2-[(1S)-1-amino-2-hydroxypropyl]-3-fluorophenol
CID 130739566
1,3-difluoro-2-propan-2-ylbenzene;1,4-difluoro-2-propan-2-ylbenzene
CID 160709728
3-(2,6-difluorophenyl)-N-methylbutan-2-amine
CID 66437420
3-fluoro-2-propan-2-ylphenol
CID 169008689
(1R,2S)-2-amino-1-(2,6-difluorophenyl)propan-1-ol
CID 28743561
1,3-difluoro-2-methylbenzene;2-methylpropane
CID 159186577
1,3-difluoro-2-pentan-3-ylbenzene
CID 123525738
2-methylpropyl 2-diazenyl-3-(3-fluoro-2-pyridinyl)-3-oxopropanoate
CID 123268690

Frequently Asked Questions

What is the IUPAC name of 1-(2,6-difluorophenyl)ethyldiazene?
The IUPAC name of 1-(2,6-difluorophenyl)ethyldiazene (CID 91333459) is 1-(2,6-difluorophenyl)ethyldiazene.
What is the SMILES notation for 1-(2,6-difluorophenyl)ethyldiazene?
The canonical SMILES for 1-(2,6-difluorophenyl)ethyldiazene is [H]/N=N/C(C)c1c(F)cccc1F.
What is the InChIKey of 1-(2,6-difluorophenyl)ethyldiazene?
The InChIKey is KWNXTBUODITTMW-VAWYXSNFSA-N. The full InChI is InChI=1S/C8H8F2N2/c1-5(12-11)8-6(9)3-2-4-7(8)10/h2-5,11H,1H3/b12-11+.
What are the key properties of 1-(2,6-difluorophenyl)ethyldiazene?
1-(2,6-difluorophenyl)ethyldiazene has a molecular weight of 170.16 g/mol, XLogP of 3.06, 2 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 1-(2,6-difluorophenyl)ethyldiazene is sourced from PubChem (CID 91333459), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).