1-(2,4-difluorophenyl)propyldiazene

C9H10F2N2 — CID 54492582

IUPAC1-(2,4-difluorophenyl)propyldiazene
SMILES[H]/N=N/C(CC)c1ccc(F)cc1F
InChIInChI=1S/C9H10F2N2/c1-2-9(13-12)7-4-3-6(10)5-8(7)11/h3-5,9,12H,2H2,1H3/b13-12+
InChIKeyXWTSQORDLNGRBH-OUKQBFOZSA-N
MW184.19 g/mol
LogP3.45
Rot. Bonds3

About 1-(2,4-difluorophenyl)propyldiazene

1-(2,4-difluorophenyl)propyldiazene (PubChem CID 54492582) has the molecular formula C9H10F2N2 and a molecular weight of 184.19 g/mol. Its IUPAC name is 1-(2,4-difluorophenyl)propyldiazene.

Molecular Properties

Compound Name1-(2,4-difluorophenyl)propyldiazene
PubChem CID54492582
Molecular FormulaC9H10F2N2
Molecular Weight184.19 g/mol
Exact Mass184.08
IUPAC Name1-(2,4-difluorophenyl)propyldiazene
SMILES[H]/N=N/C(CC)c1ccc(F)cc1F
InChIInChI=1S/C9H10F2N2/c1-2-9(13-12)7-4-3-6(10)5-8(7)11/h3-5,9,12H,2H2,1H3/b13-12+
InChIKeyXWTSQORDLNGRBH-OUKQBFOZSA-N
XLogP3.45
TPSA36.21 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds3
Heavy Atoms13
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500184.19
LogP ≤ 53.45
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

1-(2,4-difluorophenyl)-2-methoxybutan-1-amine
CID 116715202
2-(2,4-difluorophenyl)butanal
CID 83828727
1-(2,4-difluorophenyl)-N-propan-2-ylpropan-1-amine
CID 115641478
2-(aminomethyl)-1-(2,4-difluorophenyl)butan-1-ol
CID 65187853
2,4-difluoro-1-[(2R)-3-methylbutan-2-yl]benzene
CID 121459140
2-(2,4-difluorophenyl)-2-methoxyethanamine
CID 53276228
N-[bis(2,4-difluorophenyl)methyl]propan-1-amine
CID 43496293
N-(2-bromoprop-2-enyl)-1-(2,4-difluorophenyl)propan-1-amine
CID 115717252
1-(2,4-difluorophenyl)-N-ethyl-2-methoxyethanamine
CID 62801049
1-(2,4-difluorophenyl)-1-methoxybutan-2-one
CID 83225368
1-[(4-butan-2-ylphenyl)-chloromethyl]-2,4-difluorobenzene
CID 63430296
1-(2,4-difluorophenyl)-N,3-dimethylpentan-1-amine
CID 63084219

Frequently Asked Questions

What is the IUPAC name of 1-(2,4-difluorophenyl)propyldiazene?
The IUPAC name of 1-(2,4-difluorophenyl)propyldiazene (CID 54492582) is 1-(2,4-difluorophenyl)propyldiazene.
What is the SMILES notation for 1-(2,4-difluorophenyl)propyldiazene?
The canonical SMILES for 1-(2,4-difluorophenyl)propyldiazene is [H]/N=N/C(CC)c1ccc(F)cc1F.
What is the InChIKey of 1-(2,4-difluorophenyl)propyldiazene?
The InChIKey is XWTSQORDLNGRBH-OUKQBFOZSA-N. The full InChI is InChI=1S/C9H10F2N2/c1-2-9(13-12)7-4-3-6(10)5-8(7)11/h3-5,9,12H,2H2,1H3/b13-12+.
What are the key properties of 1-(2,4-difluorophenyl)propyldiazene?
1-(2,4-difluorophenyl)propyldiazene has a molecular weight of 184.19 g/mol, XLogP of 3.45, 3 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 1-(2,4-difluorophenyl)propyldiazene is sourced from PubChem (CID 54492582), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).