(1E)-N-phenylethanehydrazonoyl fluoride

C8H9FN2 — CID 118400249

IUPAC(1E)-N-phenylethanehydrazonoyl fluoride
SMILESC/C(F)=N\Nc1ccccc1
InChIInChI=1S/C8H9FN2/c1-7(9)10-11-8-5-3-2-4-6-8/h2-6,11H,1H3/b10-7+
InChIKeyJPMNOBSTVRYDSJ-JXMROGBWSA-N
MW152.17 g/mol
LogP2.40
Rot. Bonds2

About (1E)-N-phenylethanehydrazonoyl fluoride

(1E)-N-phenylethanehydrazonoyl fluoride (PubChem CID 118400249) has the molecular formula C8H9FN2 and a molecular weight of 152.17 g/mol. Its IUPAC name is (1E)-N-phenylethanehydrazonoyl fluoride.

Molecular Properties

Compound Name(1E)-N-phenylethanehydrazonoyl fluoride
PubChem CID118400249
Molecular FormulaC8H9FN2
Molecular Weight152.17 g/mol
Exact Mass152.07
IUPAC Name(1E)-N-phenylethanehydrazonoyl fluoride
SMILESC/C(F)=N\Nc1ccccc1
InChIInChI=1S/C8H9FN2/c1-7(9)10-11-8-5-3-2-4-6-8/h2-6,11H,1H3/b10-7+
InChIKeyJPMNOBSTVRYDSJ-JXMROGBWSA-N
XLogP2.40
TPSA24.39 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds2
Heavy Atoms11
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500152.17
LogP ≤ 52.40
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

Computed Properties (RDKit)

Structural Alerts{'alert_name': 'imine_1', 'substructure': 'N/A'}, {'alert_name': 'Oxygen-nitrogen_single_bond', 'substructure': 'N/A'}

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Related Compounds

N'-anilino-2-oxopropanimidamide
CID 6340113
N-[(Z)-3-methylbutan-2-ylideneamino]aniline
CID 5484372
ethane;N-[(Z)-1-phenylethylideneamino]aniline
CID 91599108
N-(3,3-dimethylbutan-2-ylideneamino)aniline
CID 85176493
2-(N-anilino-C-methylcarbonimidoyl)benzoic acid
CID 2768362
3-(phenylhydrazinylidene)pentan-2-one
CID 23263615
N-anilino-2-oxopropanimidoyl cyanide
CID 830615
(N-anilino-C-methylcarbonimidoyl)oxyphosphanyl N-phenylethanehydrazonate
CID 175029527
CID 154709621
CID 154709621
[(Z)-[(3Z)-3-(phenylhydrazinylidene)butan-2-ylidene]amino] acetate
CID 6413961
N-[(E)-4,4-dimethylpentan-2-ylideneamino]aniline
CID 14914436
(1Z)-1-(benzenesulfonyl)-1-(phenylhydrazinylidene)propan-2-one
CID 5410527

Frequently Asked Questions

What is the IUPAC name of (1E)-N-phenylethanehydrazonoyl fluoride?
The IUPAC name of (1E)-N-phenylethanehydrazonoyl fluoride (CID 118400249) is (1E)-N-phenylethanehydrazonoyl fluoride.
What is the SMILES notation for (1E)-N-phenylethanehydrazonoyl fluoride?
The canonical SMILES for (1E)-N-phenylethanehydrazonoyl fluoride is C/C(F)=N\Nc1ccccc1.
What is the InChIKey of (1E)-N-phenylethanehydrazonoyl fluoride?
The InChIKey is JPMNOBSTVRYDSJ-JXMROGBWSA-N. The full InChI is InChI=1S/C8H9FN2/c1-7(9)10-11-8-5-3-2-4-6-8/h2-6,11H,1H3/b10-7+.
What are the key properties of (1E)-N-phenylethanehydrazonoyl fluoride?
(1E)-N-phenylethanehydrazonoyl fluoride has a molecular weight of 152.17 g/mol, XLogP of 2.40, 2 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for (1E)-N-phenylethanehydrazonoyl fluoride is sourced from PubChem (CID 118400249), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).